7-[1-[[4-(aminomethyl)phenyl]methyl]indol-3-yl]-3,5-dihydro-1H-imidazo[4,5-g]quinoxaline-2,6-dione; ethanoic acid

Systemtic Name: 7-[1-[[4-(aminomethyl)phenyl]methyl]indol-3-yl]-3,5-dihydro-1H-imidazo[4,5-g]quinoxaline-2,6-dione; ethanoic acid Openeye Name: acetic acid; 7-[1-[[4-(aminomethyl)phenyl]methyl]indol-3-yl]-3,5-dihydro-1H-imidazo[4,5-g]quinoxaline-2,6-dione CAS Name: acetic acid; 7-[1-[[4-(aminomethyl)phenyl]methyl]-3-indolyl]-3,5-dihydro-1H-imidazo[4,5-g]quinoxaline-2,6-dione IUPAC Name: acetic acid; 7-[1-[[4-(aminomethyl)phenyl]methyl]indol-3-yl]-3,5-dihydro-1H-imidazo[4,5-g]quinoxaline-2,6-dione Traditional Name: acetic acid; 7-[1-[4-(aminomethyl)benzyl]indol-3-yl]-3,5-dihydro-1H-imidazo[4,5-g]quinoxaline-2,6-quinone Formula: C27H24N6O4 MolecularWeight: 496.51726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)CN)C4=NC5=CC6=C(C=C5NC4=O)NC(=O)N6

Isomeric SMILES

CC(=O)O.C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)CN)C4=NC5=CC6=C(C=C5NC4=O)NC(=O)N6

InChI

InChI=1S/C25H20N6O2.C2H4O2/c26-11-14-5-7-15(8-6-14)12-31-13-17(16-3-1-2-4-22(16)31)23-24(32)28-19-10-21-20(9-18(19)27-23)29-25(33)30-21;1-2(3)4/h1-10,13H,11-12,26H2,(H,28,32)(H2,29,30,33);1H3,(H,3,4)