6-[(2R)-2-(4-nitrophenyl)-4-oxidanyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoic acid

Systemtic Name: 6-[(2R)-2-(4-nitrophenyl)-4-oxidanyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoic acid Openeye Name: 6-[(2R)-4-hydroxy-2-(4-nitrophenyl)-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoic acid CAS Name: 6-[(2R)-4-hydroxy-2-(4-nitrophenyl)-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-1-yl]hexanoic acid IUPAC Name: 6-[(2R)-4-hydroxy-2-(4-nitrophenyl)-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]hexanoic acid Traditional Name: 6-[(5R)-3-hydroxy-2-keto-5-(4-nitrophenyl)-4-[(E)-3-phenylacryloyl]-3-pyrrolin-1-yl]hexanoic acid Formula: C25H24N2O7 MolecularWeight: 464.46726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)C2=C(C(=O)N(C2C3=CC=C(C=C3)[N+](=O)[O-])CCCCCC(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)C2=C(C(=O)N([C@@H]2C3=CC=C(C=C3)[N+](=O)[O-])CCCCCC(=O)O)O

InChI

InChI=1S/C25H24N2O7/c28-20(15-10-17-7-3-1-4-8-17)22-23(18-11-13-19(14-12-18)27(33)34)26(25(32)24(22)31)16-6-2-5-9-21(29)30/h1,3-4,7-8,10-15,23,31H,2,5-6,9,16H2,(H,29,30)/b15-10+/t23-/m1/s1