DTXSID70943172

1,2,10-trimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-11-ol chloride

CAS: 20911-73-3

Molecular Formula	`C21H26ClNO4`
Molecular Weight	391.9 g/mol
Topological Polar Surface Area	47.9 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	391.15503
Heavy Atoms	27
Complexity	512.0

Chemical Identifiers

CAS Number	20911-73-3
SMILES	`C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)OC)OC)C.[Cl-]`
InChIKey	`PAEPOVLQEIALGP-UHFFFAOYSA-N`

📖 Product Overview

DTXSID70943172 (CAS: 20911-73-3) is a chemical compound with molecular formula C21H26ClNO4 and molecular weight 391.9 g/mol. Its IUPAC systematic name is 1,2,10-trimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium-11-ol chloride. Topological Polar Surface Area 47.9 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 3 Exact Mass 391.15503 Heavy Atoms 27 Complexity 512.0 InChI Key: PAEPOVLQEIALGP-UHFFFAOYSA-N. SMILES: C[N+]1(CCC2=CC(=C(C3=C2C1CC4=C3C(=C(C=C4)OC)O)OC)OC)C.[Cl-].

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