3-[1-(3-azanylpropyl)-5-phenylmethoxy-indol-3-yl]-6,7,8,9-tetrahydro-1H-benzo[g]quinoxalin-2-one; ethanoic acid

Systemtic Name: 3-[1-(3-azanylpropyl)-5-phenylmethoxy-indol-3-yl]-6,7,8,9-tetrahydro-1H-benzo[g]quinoxalin-2-one; ethanoic acid Openeye Name: acetic acid; 3-[1-(3-aminopropyl)-5-benzyloxy-indol-3-yl]-6,7,8,9-tetrahydro-1H-benzo[g]quinoxalin-2-one CAS Name: acetic acid; 3-[1-(3-aminopropyl)-5-phenylmethoxy-3-indolyl]-6,7,8,9-tetrahydro-1H-benzo[g]quinoxalin-2-one IUPAC Name: acetic acid; 3-[1-(3-aminopropyl)-5-phenylmethoxyindol-3-yl]-6,7,8,9-tetrahydro-1H-benzo[g]quinoxalin-2-one Traditional Name: acetic acid; 3-[1-(3-aminopropyl)-5-benzoxy-indol-3-yl]-6,7,8,9-tetrahydro-1H-benzo[g]quinoxalin-2-one Formula: C32H34N4O4 MolecularWeight: 538.63676

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1CCC2=CC3=C(C=C2C1)NC(=O)C(=N3)C4=CN(C5=C4C=C(C=C5)OCC6=CC=CC=C6)CCCN

Isomeric SMILES

CC(=O)O.C1CCC2=CC3=C(C=C2C1)NC(=O)C(=N3)C4=CN(C5=C4C=C(C=C5)OCC6=CC=CC=C6)CCCN

InChI

InChI=1S/C30H30N4O2.C2H4O2/c31-13-6-14-34-18-25(24-17-23(11-12-28(24)34)36-19-20-7-2-1-3-8-20)29-30(35)33-27-16-22-10-5-4-9-21(22)15-26(27)32-29;1-2(3)4/h1-3,7-8,11-12,15-18H,4-6,9-10,13-14,19,31H2,(H,33,35);1H3,(H,3,4)