[2-[(2-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl] 3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate

Systemtic Name: [2-[(2-aminocarbonylphenyl)amino]-2-oxidanylidene-ethyl] 3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate Openeye Name: [2-(2-carbamoylanilino)-2-oxo-ethyl] 3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate CAS Name: 3-(1,3-diphenyl-4-pyrazolyl)-2-propenoic acid [2-(2-carbamoylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-carbamoylanilino)-2-oxoethyl] 3-(1,3-diphenylpyrazol-4-yl)prop-2-enoate Traditional Name: 3-(1,3-diphenylpyrazol-4-yl)acrylic acid [2-(2-carbamoylanilino)-2-keto-ethyl] ester Formula: C27H22N4O4 MolecularWeight: 466.48798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)OCC(=O)NC3=CC=CC=C3C(=O)N)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)OCC(=O)NC3=CC=CC=C3C(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C27H22N4O4/c28-27(34)22-13-7-8-14-23(22)29-24(32)18-35-25(33)16-15-20-17-31(21-11-5-2-6-12-21)30-26(20)19-9-3-1-4-10-19/h1-17H,18H2,(H2,28,34)(H,29,32)