3-[1-(4-azanylbutyl)indol-3-yl]-1H-benzo[g]quinoxalin-2-one; ethanoic acid

Systemtic Name: 3-[1-(4-azanylbutyl)indol-3-yl]-1H-benzo[g]quinoxalin-2-one; ethanoic acid Openeye Name: acetic acid; 3-[1-(4-aminobutyl)indol-3-yl]-1H-benzo[g]quinoxalin-2-one CAS Name: acetic acid; 3-[1-(4-aminobutyl)-3-indolyl]-1H-benzo[g]quinoxalin-2-one IUPAC Name: acetic acid; 3-[1-(4-aminobutyl)indol-3-yl]-1H-benzo[g]quinoxalin-2-one Traditional Name: acetic acid; 3-[1-(4-aminobutyl)indol-3-yl]-1H-benzo[g]quinoxalin-2-one Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1=CC=C2C=C3C(=CC2=C1)NC(=O)C(=N3)C4=CN(C5=CC=CC=C54)CCCCN

Isomeric SMILES

CC(=O)O.C1=CC=C2C=C3C(=CC2=C1)NC(=O)C(=N3)C4=CN(C5=CC=CC=C54)CCCCN

InChI

InChI=1S/C24H22N4O.C2H4O2/c25-11-5-6-12-28-15-19(18-9-3-4-10-22(18)28)23-24(29)27-21-14-17-8-2-1-7-16(17)13-20(21)26-23;1-2(3)4/h1-4,7-10,13-15H,5-6,11-12,25H2,(H,27,29);1H3,(H,3,4)