[2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] (E)-3-(4-imidazol-1-ylphenyl)prop-2-enoate

Systemtic Name: [2-(4-benzamidophenyl)-2-oxidanylidene-ethyl] (E)-3-(4-imidazol-1-ylphenyl)prop-2-enoate Openeye Name: [2-(4-benzamidophenyl)-2-oxo-ethyl] (E)-3-(4-imidazol-1-ylphenyl)prop-2-enoate CAS Name: (E)-3-[4-(1-imidazolyl)phenyl]-2-propenoic acid [2-(4-benzamidophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-benzamidophenyl)-2-oxoethyl] (E)-3-(4-imidazol-1-ylphenyl)prop-2-enoate Traditional Name: (E)-3-(4-imidazol-1-ylphenyl)acrylic acid [2-(4-benzamidophenyl)-2-keto-ethyl] ester Formula: C27H21N3O4 MolecularWeight: 451.47334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)COC(=O)C=CC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)COC(=O)/C=C/C3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C27H21N3O4/c31-25(21-9-11-23(12-10-21)29-27(33)22-4-2-1-3-5-22)18-34-26(32)15-8-20-6-13-24(14-7-20)30-17-16-28-19-30/h1-17,19H,18H2,(H,29,33)/b15-8+