2-[[3-(1-benzofuran-2-yl)phenyl]methyl-(2,4-dimethylphenyl)carbonyl-amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[3-(1-benzofuran-2-yl)phenyl]methyl-(2,4-dimethylphenyl)carbonyl-amino]-3-phenyl-propanoic acid Openeye Name: 2-[[3-(benzofuran-2-yl)phenyl]methyl-(2,4-dimethylbenzoyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[[3-(2-benzofuranyl)phenyl]methyl-[(2,4-dimethylphenyl)-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[3-(1-benzofuran-2-yl)phenyl]methyl-(2,4-dimethylbenzoyl)amino]-3-phenylpropanoic acid Traditional Name: 2-[[3-(benzofuran-2-yl)benzyl]-(2,4-dimethylbenzoyl)amino]-3-phenyl-propionic acid Formula: C33H29NO4 MolecularWeight: 503.58766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N(CC2=CC=CC(=C2)C3=CC4=CC=CC=C4O3)C(CC5=CC=CC=C5)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N(CC2=CC=CC(=C2)C3=CC4=CC=CC=C4O3)C(CC5=CC=CC=C5)C(=O)O)C

InChI

InChI=1S/C33H29NO4/c1-22-15-16-28(23(2)17-22)32(35)34(29(33(36)37)19-24-9-4-3-5-10-24)21-25-11-8-13-26(18-25)31-20-27-12-6-7-14-30(27)38-31/h3-18,20,29H,19,21H2,1-2H3,(H,36,37)