ethyl (4Z)-1-(4-bromophenyl)-2-methyl-5-oxidanylidene-4-[(3-phenoxyphenyl)methylidene]pyrrole-3-carboxylate

Systemtic Name: ethyl (4Z)-1-(4-bromophenyl)-2-methyl-5-oxidanylidene-4-[(3-phenoxyphenyl)methylidene]pyrrole-3-carboxylate Openeye Name: ethyl (4Z)-1-(4-bromophenyl)-2-methyl-5-oxo-4-[(3-phenoxyphenyl)methylene]pyrrole-3-carboxylate CAS Name: (4Z)-1-(4-bromophenyl)-2-methyl-5-oxo-4-[(3-phenoxyphenyl)methylidene]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (4Z)-1-(4-bromophenyl)-2-methyl-5-oxo-4-[(3-phenoxyphenyl)methylidene]pyrrole-3-carboxylate Traditional Name: (4Z)-1-(4-bromophenyl)-5-keto-2-methyl-4-(3-phenoxybenzylidene)-2-pyrroline-3-carboxylic acid ethyl ester Formula: C27H22BrNO4 MolecularWeight: 504.37188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)C1=CC2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CCOC(=O)C\1=C(N(C(=O)/C1=C\C2=CC(=CC=C2)OC3=CC=CC=C3)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C27H22BrNO4/c1-3-32-27(31)25-18(2)29(21-14-12-20(28)13-15-21)26(30)24(25)17-19-8-7-11-23(16-19)33-22-9-5-4-6-10-22/h4-17H,3H2,1-2H3/b24-17-