4-oxidanylidene-4-[(1-oxidanyl-3-phenyl-propan-2-yl)amino]-2-[3-(4-phenylphenyl)pyrrol-1-yl]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[(1-oxidanyl-3-phenyl-propan-2-yl)amino]-2-[3-(4-phenylphenyl)pyrrol-1-yl]butanoic acid Openeye Name: 4-[(1-benzyl-2-hydroxy-ethyl)amino]-4-oxo-2-[3-(4-phenylphenyl)pyrrol-1-yl]butanoic acid CAS Name: 4-[(1-hydroxy-3-phenylpropan-2-yl)amino]-4-oxo-2-[3-(4-phenylphenyl)-1-pyrrolyl]butanoic acid IUPAC Name: 4-[(1-hydroxy-3-phenylpropan-2-yl)amino]-4-oxo-2-[3-(4-phenylphenyl)pyrrol-1-yl]butanoic acid Traditional Name: 4-[(1-benzyl-2-hydroxy-ethyl)amino]-4-keto-2-[3-(4-phenylphenyl)pyrrol-1-yl]butyric acid Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CO)NC(=O)CC(C(=O)O)N2C=CC(=C2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC(CO)NC(=O)CC(C(=O)O)N2C=CC(=C2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H28N2O4/c32-20-26(17-21-7-3-1-4-8-21)30-28(33)18-27(29(34)35)31-16-15-25(19-31)24-13-11-23(12-14-24)22-9-5-2-6-10-22/h1-16,19,26-27,32H,17-18,20H2,(H,30,33)(H,34,35)