ethyl 1-[4-[(5-methyl-2,4-diphenyl-pyrazol-3-yl)amino]-4-oxidanylidene-butanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-[(5-methyl-2,4-diphenyl-pyrazol-3-yl)amino]-4-oxidanylidene-butanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[4-[(5-methyl-2,4-diphenyl-pyrazol-3-yl)amino]-4-oxo-butanoyl]piperidine-4-carboxylate CAS Name: 1-[4-[(5-methyl-2,4-diphenyl-3-pyrazolyl)amino]-1,4-dioxobutyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(5-methyl-2,4-diphenylpyrazol-3-yl)amino]-4-oxobutanoyl]piperidine-4-carboxylate Traditional Name: 1-[4-keto-4-[(5-methyl-2,4-diphenyl-pyrazol-3-yl)amino]butanoyl]isonipecotic acid ethyl ester Formula: C28H32N4O4 MolecularWeight: 488.57808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCC(=O)NC2=C(C(=NN2C3=CC=CC=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCC(=O)NC2=C(C(=NN2C3=CC=CC=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C28H32N4O4/c1-3-36-28(35)22-16-18-31(19-17-22)25(34)15-14-24(33)29-27-26(21-10-6-4-7-11-21)20(2)30-32(27)23-12-8-5-9-13-23/h4-13,22H,3,14-19H2,1-2H3,(H,29,33)