3-[1-(3-azanylpropyl)-5-phenylmethoxy-indol-3-yl]-7-phenyl-1H-quinoxalin-2-one; ethanoic acid

Systemtic Name: 3-[1-(3-azanylpropyl)-5-phenylmethoxy-indol-3-yl]-7-phenyl-1H-quinoxalin-2-one; ethanoic acid Openeye Name: acetic acid; 3-[1-(3-aminopropyl)-5-benzyloxy-indol-3-yl]-7-phenyl-1H-quinoxalin-2-one CAS Name: acetic acid; 3-[1-(3-aminopropyl)-5-phenylmethoxy-3-indolyl]-7-phenyl-1H-quinoxalin-2-one IUPAC Name: acetic acid; 3-[1-(3-aminopropyl)-5-phenylmethoxyindol-3-yl]-7-phenyl-1H-quinoxalin-2-one Traditional Name: acetic acid; 3-[1-(3-aminopropyl)-5-benzoxy-indol-3-yl]-7-phenyl-1H-quinoxalin-2-one Formula: C34H32N4O4 MolecularWeight: 560.64228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1=CC=C(C=C1)COC2=CC3=C(C=C2)N(C=C3C4=NC5=C(C=C(C=C5)C6=CC=CC=C6)NC4=O)CCCN

Isomeric SMILES

CC(=O)O.C1=CC=C(C=C1)COC2=CC3=C(C=C2)N(C=C3C4=NC5=C(C=C(C=C5)C6=CC=CC=C6)NC4=O)CCCN

InChI

InChI=1S/C32H28N4O2.C2H4O2/c33-16-7-17-36-20-27(26-19-25(13-15-30(26)36)38-21-22-8-3-1-4-9-22)31-32(37)35-29-18-24(12-14-28(29)34-31)23-10-5-2-6-11-23;1-2(3)4/h1-6,8-15,18-20H,7,16-17,21,33H2,(H,35,37);1H3,(H,3,4)