propan-2-yl 1-ethyl-4-[(4-methoxyphenyl)carbonylamino]pyrazole-3-carboxylate

Systemtic Name: propan-2-yl 1-ethyl-4-[(4-methoxyphenyl)carbonylamino]pyrazole-3-carboxylate Openeye Name: isopropyl 1-ethyl-4-[(4-methoxybenzoyl)amino]pyrazole-3-carboxylate CAS Name: 1-ethyl-4-[[(4-methoxyphenyl)-oxomethyl]amino]-3-pyrazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-ethyl-4-[(4-methoxybenzoyl)amino]pyrazole-3-carboxylate Traditional Name: 1-ethyl-4-(p-anisoylamino)pyrazole-3-carboxylic acid isopropyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O4/c1-5-20-10-14(15(19-20)17(22)24-11(2)3)18-16(21)12-6-8-13(23-4)9-7-12/h6-11H,5H2,1-4H3,(H,18,21)