methyl 2-chloranyl-5-[(3E)-3-[(4-nitrophenyl)methylidene]-2-oxidanylidene-5-phenyl-pyrrol-1-yl]benzoate

Systemtic Name: methyl 2-chloranyl-5-[(3E)-3-[(4-nitrophenyl)methylidene]-2-oxidanylidene-5-phenyl-pyrrol-1-yl]benzoate Openeye Name: methyl 2-chloro-5-[(3E)-3-[(4-nitrophenyl)methylene]-2-oxo-5-phenyl-pyrrol-1-yl]benzoate CAS Name: 2-chloro-5-[(3E)-3-[(4-nitrophenyl)methylidene]-2-oxo-5-phenyl-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[(3E)-3-[(4-nitrophenyl)methylidene]-2-oxo-5-phenylpyrrol-1-yl]benzoate Traditional Name: 2-chloro-5-[(3E)-2-keto-3-(4-nitrobenzylidene)-5-phenyl-2-pyrrolin-1-yl]benzoic acid methyl ester Formula: C25H17ClN2O5 MolecularWeight: 460.86588

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)N2C(=CC(=CC3=CC=C(C=C3)[N+](=O)[O-])C2=O)C4=CC=CC=C4)Cl

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)N2C(=C/C(=C\C3=CC=C(C=C3)[N+](=O)[O-])/C2=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H17ClN2O5/c1-33-25(30)21-15-20(11-12-22(21)26)27-23(17-5-3-2-4-6-17)14-18(24(27)29)13-16-7-9-19(10-8-16)28(31)32/h2-15H,1H3/b18-13+