4-[(2-oxidanyl-2,3-dihydro-1H-inden-1-yl)amino]-4-oxidanylidene-3-[3-(4-pyridin-4-ylphenyl)pyrrol-1-yl]butanoic acid

Systemtic Name: 4-[(2-oxidanyl-2,3-dihydro-1H-inden-1-yl)amino]-4-oxidanylidene-3-[3-(4-pyridin-4-ylphenyl)pyrrol-1-yl]butanoic acid Openeye Name: 4-[(2-hydroxyindan-1-yl)amino]-4-oxo-3-[3-[4-(4-pyridyl)phenyl]pyrrol-1-yl]butanoic acid CAS Name: 4-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-4-oxo-3-[3-(4-pyridin-4-ylphenyl)-1-pyrrolyl]butanoic acid IUPAC Name: 4-[(2-hydroxy-2,3-dihydro-1H-inden-1-yl)amino]-4-oxo-3-[3-(4-pyridin-4-ylphenyl)pyrrol-1-yl]butanoic acid Traditional Name: 4-[(2-hydroxyindan-1-yl)amino]-4-keto-3-[3-[4-(4-pyridyl)phenyl]pyrrol-1-yl]butyric acid Formula: C28H25N3O4 MolecularWeight: 467.5158

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=CC=CC=C21)NC(=O)C(CC(=O)O)N3C=CC(=C3)C4=CC=C(C=C4)C5=CC=NC=C5)O

Isomeric SMILES

C1C(C(C2=CC=CC=C21)NC(=O)C(CC(=O)O)N3C=CC(=C3)C4=CC=C(C=C4)C5=CC=NC=C5)O

InChI

InChI=1S/C28H25N3O4/c32-25-15-21-3-1-2-4-23(21)27(25)30-28(35)24(16-26(33)34)31-14-11-22(17-31)19-7-5-18(6-8-19)20-9-12-29-13-10-20/h1-14,17,24-25,27,32H,15-16H2,(H,30,35)(H,33,34)