AC1LD3U7 structure

AC1LD3U7

2-amino-1'-methyl-2'-oxospiro[4a,5,6,7-tetrahydronaphthalene-4,3'-indole]-1,3,3-tricarbonitrile

Also Known As: Oprea1_724363|J2.821.091D|2-amino-1'-methyl-2'-oxospiro[4a,5,6,7-tetrahydronaphthalene-4,3'-indole]-1,3,3-tricarbonitrile|AK-777/40838237|SR-01000002922-2|2-amino-1',3'-dihydro-1'-methyl-2'-oxo-4a,5,6,7-tetrahydro-1,3,3(4h)-tricyanospiro[naphthalene-4,3'-(2'H)-indole]|3'-AMINO-1-METHYL-2-OXO-1,2,6',7',8',8'A-HEXAHYDRO-2'H-SPIRO[INDOLE-3,1'-NAPHTHALENE]-2',2',4'-TRICARBONITRILE|3'-amino-1-methyl-2-oxo-1,2,6',7',8',8a'-hexahydro-2'H-spiro[indole-3,1'-naphthalene]-2',2',4'-tricarbonitrile|1-Methyl-2 ,2 ,4 -tricyano-3 -amino-1,2,6 ,7 ,8 ,8a -hexahydrospiro[3H-indole-3,1 (2 H)-naphthalene]-2-one|3'-amino-1-methyl-2-oxo-6',7',8',8a'-tetrahydro-2'H-spiro[indoline-3,1'-naphthalene]-2',2',4'-tricarbonitrile

CAS: 445223-06-3
Molecular Formula C21H17N5O
Molecular Weight 355.1433 g/mol
LogP 1.4
Topological Polar Surface Area 118.0 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 0
Exact Mass 355.1433
Monoisotopic Mass 355.1433
Heavy Atoms 27
Complexity 915.0

Chemical Identifiers

CAS Number 445223-06-3
SMILES CN1C2=CC=CC=C2C3(C1=O)C4CCCC=C4C(=C(C3(C#N)C#N)N)C#N
InChIKey ZZDLIHXGIYUXEB-UHFFFAOYSA-N

Product Overview

AC1LD3U7 (CAS 445223-06-3), with molecular formula C21H17N5O and molecular weight 355.1433 g/mol. IUPAC: 2-amino-1'-methyl-2'-oxospiro[4a,5,6,7-tetrahydronaphthalene-4,3'-indole]-1,3,3-tricarbonitrile.

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