4-[[(Z)-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]amino]benzoic acid

Systemtic Name: 4-[[(Z)-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]amino]benzoic acid Openeye Name: 4-[[(Z)-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]amino]benzoic acid CAS Name: 4-[[(Z)-3-[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-[[(Z)-3-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]prop-2-enoyl]amino]benzoic acid Traditional Name: 4-[[(Z)-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]acryloyl]amino]benzoic acid Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C=CC(=O)NC3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2/C=C\C(=O)NC3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C26H21N3O4/c1-33-23-14-9-18(10-15-23)25-20(17-29(28-25)22-5-3-2-4-6-22)11-16-24(30)27-21-12-7-19(8-13-21)26(31)32/h2-17H,1H3,(H,27,30)(H,31,32)/b16-11-