[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 3-(4-ethylphenyl)-1-(2-methylphenyl)pyrazole-4-carboxylate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 3-(4-ethylphenyl)-1-(2-methylphenyl)pyrazole-4-carboxylate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 3-(4-ethylphenyl)-1-(o-tolyl)pyrazole-4-carboxylate CAS Name: 3-(4-ethylphenyl)-1-(2-methylphenyl)-4-pyrazolecarboxylic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 3-(4-ethylphenyl)-1-(2-methylphenyl)pyrazole-4-carboxylate Traditional Name: 3-(4-ethylphenyl)-1-(o-tolyl)pyrazole-4-carboxylic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN(C=C2C(=O)OC(C)C(=O)N)C3=CC=CC=C3C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN(C=C2C(=O)O[C@H](C)C(=O)N)C3=CC=CC=C3C

InChI

InChI=1S/C22H23N3O3/c1-4-16-9-11-17(12-10-16)20-18(22(27)28-15(3)21(23)26)13-25(24-20)19-8-6-5-7-14(19)2/h5-13,15H,4H2,1-3H3,(H2,23,26)/t15-/m1/s1