3-[(2R)-2-(4-methylphenyl)-4-oxidanidyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]benzoate

Systemtic Name: 3-[(2R)-2-(4-methylphenyl)-4-oxidanidyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]benzoate Openeye Name: 3-[(2R)-4-oxido-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2-(p-tolyl)-2H-pyrrol-1-yl]benzoate CAS Name: 3-[(2R)-2-(4-methylphenyl)-4-oxido-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2H-pyrrol-1-yl]benzoate IUPAC Name: 3-[(2R)-2-(4-methylphenyl)-4-oxido-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-1-yl]benzoate Traditional Name: 3-[(5R)-2-keto-3-oxido-4-[(E)-3-phenylacryloyl]-5-(p-tolyl)-3-pyrrolin-1-yl]benzoate Formula: C27H19NO5-2 MolecularWeight: 437.44346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=CC=CC(=C3)C(=O)[O-])[O-])C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H]2C(=C(C(=O)N2C3=CC=CC(=C3)C(=O)[O-])[O-])C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H21NO5/c1-17-10-13-19(14-11-17)24-23(22(29)15-12-18-6-3-2-4-7-18)25(30)26(31)28(24)21-9-5-8-20(16-21)27(32)33/h2-16,24,30H,1H3,(H,32,33)/p-2/b15-12+/t24-/m1/s1