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

Systemtic Name: 2-azanyl-N-(1,3-benzodioxol-5-ylmethyl)-1-(4-ethanoylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Openeye Name: 1-(4-acetylphenyl)-2-amino-N-(1,3-benzodioxol-5-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide CAS Name: 1-(4-acetylphenyl)-2-amino-N-(1,3-benzodioxol-5-ylmethyl)-3-pyrrolo[3,2-b]quinoxalinecarboxamide IUPAC Name: 1-(4-acetylphenyl)-2-amino-N-(1,3-benzodioxol-5-ylmethyl)pyrrolo[3,2-b]quinoxaline-3-carboxamide Traditional Name: 1-(4-acetylphenyl)-2-amino-N-piperonyl-pyrrolo[3,2-b]quinoxaline-3-carboxamide Formula: C27H21N5O4 MolecularWeight: 479.48674

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC6=C(C=C5)OCO6)N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC6=C(C=C5)OCO6)N

InChI

InChI=1S/C27H21N5O4/c1-15(33)17-7-9-18(10-8-17)32-25(28)23(24-26(32)31-20-5-3-2-4-19(20)30-24)27(34)29-13-16-6-11-21-22(12-16)36-14-35-21/h2-12H,13-14,28H2,1H3,(H,29,34)