ethyl 4-[(E)-[1-(4-bromophenyl)-2-oxidanylidene-5-phenyl-pyrrol-3-ylidene]methyl]benzoate

Systemtic Name: ethyl 4-[(E)-[1-(4-bromophenyl)-2-oxidanylidene-5-phenyl-pyrrol-3-ylidene]methyl]benzoate Openeye Name: ethyl 4-[(E)-[1-(4-bromophenyl)-2-oxo-5-phenyl-pyrrol-3-ylidene]methyl]benzoate CAS Name: 4-[(E)-[1-(4-bromophenyl)-2-oxo-5-phenyl-3-pyrrolylidene]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(E)-[1-(4-bromophenyl)-2-oxo-5-phenylpyrrol-3-ylidene]methyl]benzoate Traditional Name: 4-[(E)-[1-(4-bromophenyl)-2-keto-5-phenyl-2-pyrrolin-3-ylidene]methyl]benzoic acid ethyl ester Formula: C26H20BrNO3 MolecularWeight: 474.3459

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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)Br)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)Br)C4=CC=CC=C4

InChI

InChI=1S/C26H20BrNO3/c1-2-31-26(30)20-10-8-18(9-11-20)16-21-17-24(19-6-4-3-5-7-19)28(25(21)29)23-14-12-22(27)13-15-23/h3-17H,2H2,1H3/b21-16+