[4-(4-cyanophenyl)phenyl] (4E)-4-[(2-bromophenyl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: [4-(4-cyanophenyl)phenyl] (4E)-4-[(2-bromophenyl)carbonylhydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] (4E)-4-[(2-bromobenzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-4-[[(2-bromophenyl)-oxomethyl]hydrazinylidene]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] (4E)-4-[(2-bromobenzoyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-[(2-bromobenzoyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C30H22BrN3O4 MolecularWeight: 568.41738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=CC=C3Br)CCC2)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=CC=C3Br)/CCC2)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C30H22BrN3O4/c1-18-27-25(33-34-29(35)23-5-2-3-6-24(23)31)7-4-8-26(27)38-28(18)30(36)37-22-15-13-21(14-16-22)20-11-9-19(17-32)10-12-20/h2-3,5-6,9-16H,4,7-8H2,1H3,(H,34,35)/b33-25+