ethyl (1S,2R)-4-methyl-2-(4-nitrophenyl)-5-oxidanylidene-3-phenyl-cyclopent-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,2R)-4-methyl-2-(4-nitrophenyl)-5-oxidanylidene-3-phenyl-cyclopent-3-ene-1-carboxylate Openeye Name: ethyl (1S,2R)-4-methyl-2-(4-nitrophenyl)-5-oxo-3-phenyl-cyclopent-3-ene-1-carboxylate CAS Name: (1S,2R)-4-methyl-2-(4-nitrophenyl)-5-oxo-3-phenyl-1-cyclopent-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2R)-4-methyl-2-(4-nitrophenyl)-5-oxo-3-phenylcyclopent-3-ene-1-carboxylate Traditional Name: (1S,5R)-2-keto-3-methyl-5-(4-nitrophenyl)-4-phenyl-cyclopent-3-ene-1-carboxylic acid ethyl ester Formula: C21H19NO5 MolecularWeight: 365.37926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=C(C1=O)C)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](C(=C(C1=O)C)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H19NO5/c1-3-27-21(24)19-18(15-9-11-16(12-10-15)22(25)26)17(13(2)20(19)23)14-7-5-4-6-8-14/h4-12,18-19H,3H2,1-2H3/t18-,19+/m1/s1