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

Systemtic Name: 3-[(phenylmethyl)-[4-[4-[2-(phenylmethyl)-1-benzofuran-3-yl]phenyl]phenyl]carbonyl-amino]propanoic acid Openeye Name: 3-[benzyl-[4-[4-(2-benzylbenzofuran-3-yl)phenyl]benzoyl]amino]propanoic acid CAS Name: 3-[[oxo-[4-[4-[2-(phenylmethyl)-3-benzofuranyl]phenyl]phenyl]methyl]-(phenylmethyl)amino]propanoic acid IUPAC Name: 3-[benzyl-[4-[4-(2-benzyl-1-benzofuran-3-yl)phenyl]benzoyl]amino]propanoic acid Traditional Name: 3-[benzyl-[4-[4-(2-benzylbenzofuran-3-yl)phenyl]benzoyl]amino]propionic acid Formula: C38H31NO4 MolecularWeight: 565.65704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3O2)C4=CC=C(C=C4)C5=CC=C(C=C5)C(=O)N(CCC(=O)O)CC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3O2)C4=CC=C(C=C4)C5=CC=C(C=C5)C(=O)N(CCC(=O)O)CC6=CC=CC=C6

InChI

InChI=1S/C38H31NO4/c40-36(41)23-24-39(26-28-11-5-2-6-12-28)38(42)32-21-17-30(18-22-32)29-15-19-31(20-16-29)37-33-13-7-8-14-34(33)43-35(37)25-27-9-3-1-4-10-27/h1-22H,23-26H2,(H,40,41)