(phenylmethyl) 2-azanyl-1-(3-ethanoylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: (phenylmethyl) 2-azanyl-1-(3-ethanoylphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: benzyl 1-(3-acetylphenyl)-2-amino-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 1-(3-acetylphenyl)-2-amino-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-(3-acetylphenyl)-2-aminopyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-(3-acetylphenyl)-2-amino-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid benzyl ester Formula: C26H20N4O3 MolecularWeight: 436.462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)OCC5=CC=CC=C5)N

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)OCC5=CC=CC=C5)N

InChI

InChI=1S/C26H20N4O3/c1-16(31)18-10-7-11-19(14-18)30-24(27)22(26(32)33-15-17-8-3-2-4-9-17)23-25(30)29-21-13-6-5-12-20(21)28-23/h2-14H,15,27H2,1H3