Compound C20H15N3O6

19-ethyl-19-hydroxy-7-nitro-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaene-14,18-dione

CAS: 104195-61-1

Molecular Formula	`C20H15N3O6`
Molecular Weight	393.3 g/mol
LogP	0.8
Topological Polar Surface Area	126.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	1
Exact Mass	393.0961
Heavy Atoms	29
Complexity	861.0

Chemical Identifiers

CAS Number	104195-61-1
SMILES	`CCC1(C2=C(COC1=O)C(=O)N3CC4=C(C3=C2)N=C5C=CC(=CC5=C4)[N+](=O)[O-])O`
InChIKey	`XLHNAFUKOSPOAT-UHFFFAOYSA-N`

📖 Product Overview

Compound C20H15N3O6 (CAS: 104195-61-1) is a chemical compound with molecular formula C20H15N3O6 and molecular weight 393.3 g/mol. Its IUPAC systematic name is 19-ethyl-19-hydroxy-7-nitro-17-oxa-3,13-diazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaene-14,18-dione. LogP 0.8 Topological Polar Surface Area 126.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 1 Exact Mass 393.0961 Heavy Atoms 29 Complexity 861.0 InChI Key: XLHNAFUKOSPOAT-UHFFFAOYSA-N. SMILES: CCC1(C2=C(COC1=O)C(=O)N3CC4=C(C3=C2)N=C5C=CC(=CC5=C4)[N+](=O)[O-])O.

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