2-azanyl-N-(4-methylphenyl)-1-(4-octoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-N-(4-methylphenyl)-1-(4-octoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(4-octoxyphenyl)-N-(p-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-N-(4-methylphenyl)-1-(4-octoxyphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-N-(4-methylphenyl)-1-(4-octoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-(4-octoxyphenyl)-N-(p-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C32H35N5O2 MolecularWeight: 521.6526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NC5=CC=C(C=C5)C)N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NC5=CC=C(C=C5)C)N

InChI

InChI=1S/C32H35N5O2/c1-3-4-5-6-7-10-21-39-25-19-17-24(18-20-25)37-30(33)28(32(38)34-23-15-13-22(2)14-16-23)29-31(37)36-27-12-9-8-11-26(27)35-29/h8-9,11-20H,3-7,10,21,33H2,1-2H3,(H,34,38)