(phenylmethyl) 4-[2-[(2-ethylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[2-[(2-ethylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-4-phenyl-piperidine-1-carboxylate Openeye Name: benzyl 4-[2-[(2-ethylpyrazol-3-yl)amino]-2-oxo-ethyl]-4-phenyl-piperidine-1-carboxylate CAS Name: 4-[2-[(2-ethyl-3-pyrazolyl)amino]-2-oxoethyl]-4-phenyl-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-[(2-ethylpyrazol-3-yl)amino]-2-oxoethyl]-4-phenylpiperidine-1-carboxylate Traditional Name: 4-[2-[(2-ethylpyrazol-3-yl)amino]-2-keto-ethyl]-4-phenyl-piperidine-1-carboxylic acid benzyl ester Formula: C26H30N4O3 MolecularWeight: 446.5414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)NC(=O)CC2(CCN(CC2)C(=O)OCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=CC=N1)NC(=O)CC2(CCN(CC2)C(=O)OCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O3/c1-2-30-23(13-16-27-30)28-24(31)19-26(22-11-7-4-8-12-22)14-17-29(18-15-26)25(32)33-20-21-9-5-3-6-10-21/h3-13,16H,2,14-15,17-20H2,1H3,(H,28,31)