2-azanyl-1-(1,3-benzodioxol-5-ylmethyl)-N-(4-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide

Systemtic Name: 2-azanyl-1-(1,3-benzodioxol-5-ylmethyl)-N-(4-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-N-(p-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-N-(4-methylphenyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 2-amino-1-(1,3-benzodioxol-5-ylmethyl)-N-(4-methylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 2-amino-1-piperonyl-N-(p-tolyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C26H21N5O3 MolecularWeight: 451.47664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC6=C(C=C5)OCO6)N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC6=C(C=C5)OCO6)N

InChI

InChI=1S/C26H21N5O3/c1-15-6-9-17(10-7-15)28-26(32)22-23-25(30-19-5-3-2-4-18(19)29-23)31(24(22)27)13-16-8-11-20-21(12-16)34-14-33-20/h2-12H,13-14,27H2,1H3,(H,28,32)