3-[[2-(1,2-diphenylethoxy)indol-1-yl]carbonylamino]benzoic acid

Systemtic Name: 3-[[2-(1,2-diphenylethoxy)indol-1-yl]carbonylamino]benzoic acid Openeye Name: 3-[[2-(1,2-diphenylethoxy)indole-1-carbonyl]amino]benzoic acid CAS Name: 3-[[[2-(1,2-diphenylethoxy)-1-indolyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[2-(1,2-diphenylethoxy)indole-1-carbonyl]amino]benzoic acid Traditional Name: 3-[[2-(1,2-diphenylethoxy)indole-1-carbonyl]amino]benzoic acid Formula: C30H24N2O4 MolecularWeight: 476.52256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=CC=CC=C2)OC3=CC4=CC=CC=C4N3C(=O)NC5=CC=CC(=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C2=CC=CC=C2)OC3=CC4=CC=CC=C4N3C(=O)NC5=CC=CC(=C5)C(=O)O

InChI

InChI=1S/C30H24N2O4/c33-29(34)24-15-9-16-25(19-24)31-30(35)32-26-17-8-7-14-23(26)20-28(32)36-27(22-12-5-2-6-13-22)18-21-10-3-1-4-11-21/h1-17,19-20,27H,18H2,(H,31,35)(H,33,34)