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

Systemtic Name: methyl 4-methyl-3-[[1-(phenylmethyl)pyrazol-4-yl]carbonylamino]benzoate Openeye Name: methyl 3-[(1-benzylpyrazole-4-carbonyl)amino]-4-methyl-benzoate CAS Name: 4-methyl-3-[[oxo-[1-(phenylmethyl)-4-pyrazolyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(1-benzylpyrazole-4-carbonyl)amino]-4-methylbenzoate Traditional Name: 3-[(1-benzylpyrazole-4-carbonyl)amino]-4-methyl-benzoic acid methyl ester Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H19N3O3/c1-14-8-9-16(20(25)26-2)10-18(14)22-19(24)17-11-21-23(13-17)12-15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3,(H,22,24)