2-[1-(3-azanylpropyl)-6-phenylmethoxy-indol-3-yl]-4H-benzo[f]quinoxalin-3-one; ethanoic acid

Systemtic Name: 2-[1-(3-azanylpropyl)-6-phenylmethoxy-indol-3-yl]-4H-benzo[f]quinoxalin-3-one; ethanoic acid Openeye Name: acetic acid; 2-[1-(3-aminopropyl)-6-benzyloxy-indol-3-yl]-4H-benzo[f]quinoxalin-3-one CAS Name: acetic acid; 2-[1-(3-aminopropyl)-6-phenylmethoxy-3-indolyl]-4H-benzo[f]quinoxalin-3-one IUPAC Name: acetic acid; 2-[1-(3-aminopropyl)-6-phenylmethoxyindol-3-yl]-4H-benzo[f]quinoxalin-3-one Traditional Name: acetic acid; 2-[1-(3-aminopropyl)-6-benzoxy-indol-3-yl]-4H-benzo[f]quinoxalin-3-one Formula: C32H30N4O4 MolecularWeight: 534.605

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=CN3CCCN)C4=NC5=C(C=CC6=CC=CC=C65)NC4=O

Isomeric SMILES

CC(=O)O.C1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=CN3CCCN)C4=NC5=C(C=CC6=CC=CC=C65)NC4=O

InChI

InChI=1S/C30H26N4O2.C2H4O2/c31-15-6-16-34-18-25(24-13-12-22(17-27(24)34)36-19-20-7-2-1-3-8-20)29-30(35)32-26-14-11-21-9-4-5-10-23(21)28(26)33-29;1-2(3)4/h1-5,7-14,17-18H,6,15-16,19,31H2,(H,32,35);1H3,(H,3,4)