methyl 3-[[3-(4-methylphenyl)-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[3-(4-methylphenyl)-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]benzoate Openeye Name: methyl 3-[[1-benzyl-3-(p-tolyl)pyrazole-4-carbonyl]amino]benzoate CAS Name: 3-[[[3-(4-methylphenyl)-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[1-benzyl-3-(4-methylphenyl)pyrazole-4-carbonyl]amino]benzoate Traditional Name: 3-[[1-benzyl-3-(p-tolyl)pyrazole-4-carbonyl]amino]benzoic acid methyl ester Formula: C26H23N3O3 MolecularWeight: 425.47912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC=CC(=C3)C(=O)OC)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC=CC(=C3)C(=O)OC)CC4=CC=CC=C4

InChI

InChI=1S/C26H23N3O3/c1-18-11-13-20(14-12-18)24-23(17-29(28-24)16-19-7-4-3-5-8-19)25(30)27-22-10-6-9-21(15-22)26(31)32-2/h3-15,17H,16H2,1-2H3,(H,27,30)