methyl 1-ethyl-4-[(2-methylphenyl)carbonylamino]pyrazole-3-carboxylate

Systemtic Name: methyl 1-ethyl-4-[(2-methylphenyl)carbonylamino]pyrazole-3-carboxylate Openeye Name: methyl 1-ethyl-4-[(2-methylbenzoyl)amino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[(2-methylphenyl)-oxomethyl]amino]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-4-[(2-methylbenzoyl)amino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-(o-toluoylamino)pyrazole-3-carboxylic acid methyl ester Formula: C15H17N3O3 MolecularWeight: 287.31378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)OC)NC(=O)C2=CC=CC=C2C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)OC)NC(=O)C2=CC=CC=C2C

InChI

InChI=1S/C15H17N3O3/c1-4-18-9-12(13(17-18)15(20)21-3)16-14(19)11-8-6-5-7-10(11)2/h5-9H,4H2,1-3H3,(H,16,19)