ethyl 1-[2-[[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]amino]-2-oxidanylidene-ethyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]amino]-2-oxo-ethyl]piperidine-4-carboxylate CAS Name: 1-[2-[[3,5-dimethyl-1-(4-methylphenyl)-4-pyrazolyl]amino]-2-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]amino]-2-oxoethyl]piperidine-4-carboxylate Traditional Name: 1-[2-[[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]amino]-2-keto-ethyl]isonipecotic acid ethyl ester Formula: C22H30N4O3 MolecularWeight: 398.4986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC(=O)NC2=C(N(N=C2C)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC(=O)NC2=C(N(N=C2C)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C22H30N4O3/c1-5-29-22(28)18-10-12-25(13-11-18)14-20(27)23-21-16(3)24-26(17(21)4)19-8-6-15(2)7-9-19/h6-9,18H,5,10-14H2,1-4H3,(H,23,27)