2-chloranyl-5-[(3Z)-3-[(4-ethoxycarbonylphenyl)methylidene]-2-oxidanylidene-5-phenyl-pyrrol-1-yl]benzoic acid

Systemtic Name: 2-chloranyl-5-[(3Z)-3-[(4-ethoxycarbonylphenyl)methylidene]-2-oxidanylidene-5-phenyl-pyrrol-1-yl]benzoic acid Openeye Name: 2-chloro-5-[(3Z)-3-[(4-ethoxycarbonylphenyl)methylene]-2-oxo-5-phenyl-pyrrol-1-yl]benzoic acid CAS Name: 2-chloro-5-[(3Z)-3-[(4-ethoxycarbonylphenyl)methylidene]-2-oxo-5-phenyl-1-pyrrolyl]benzoic acid IUPAC Name: 2-chloro-5-[(3Z)-3-[(4-ethoxycarbonylphenyl)methylidene]-2-oxo-5-phenylpyrrol-1-yl]benzoic acid Traditional Name: 5-[(3Z)-3-(4-carbethoxybenzylidene)-2-keto-5-phenyl-2-pyrrolin-1-yl]-2-chloro-benzoic acid Formula: C27H20ClNO5 MolecularWeight: 473.9044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C=C2C=C(N(C2=O)C3=CC(=C(C=C3)Cl)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)/C=C\2/C=C(N(C2=O)C3=CC(=C(C=C3)Cl)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C27H20ClNO5/c1-2-34-27(33)19-10-8-17(9-11-19)14-20-15-24(18-6-4-3-5-7-18)29(25(20)30)21-12-13-23(28)22(16-21)26(31)32/h3-16H,2H2,1H3,(H,31,32)/b20-14-