(Z)-3-(1,3-diphenylpyrazol-4-yl)-2-[(4-methylphenyl)carbonylamino]prop-2-enoic acid

Systemtic Name: (Z)-3-(1,3-diphenylpyrazol-4-yl)-2-[(4-methylphenyl)carbonylamino]prop-2-enoic acid Openeye Name: (Z)-3-(1,3-diphenylpyrazol-4-yl)-2-[(4-methylbenzoyl)amino]prop-2-enoic acid CAS Name: (Z)-3-(1,3-diphenyl-4-pyrazolyl)-2-[[(4-methylphenyl)-oxomethyl]amino]-2-propenoic acid IUPAC Name: (Z)-3-(1,3-diphenylpyrazol-4-yl)-2-[(4-methylbenzoyl)amino]prop-2-enoic acid Traditional Name: (Z)-3-(1,3-diphenylpyrazol-4-yl)-2-(p-toluoylamino)acrylic acid Formula: C26H21N3O3 MolecularWeight: 423.46324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)/C(=O)O

InChI

InChI=1S/C26H21N3O3/c1-18-12-14-20(15-13-18)25(30)27-23(26(31)32)16-21-17-29(22-10-6-3-7-11-22)28-24(21)19-8-4-2-5-9-19/h2-17H,1H3,(H,27,30)(H,31,32)/b23-16-