ethyl 1-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-3-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidin-3-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidine-3-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-[(1,5-dimethyl-4-pyrazolyl)sulfonyl]-3-piperidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(1,5-dimethylpyrazol-4-yl)sulfonylpiperidine-3-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-(1,5-dimethylpyrazol-4-yl)sulfonylnipecotoyl]nipecotic acid ethyl ester Formula: C19H30N4O5S MolecularWeight: 426.5303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CCCN(C2)S(=O)(=O)C3=C(N(N=C3)C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CCCN(C2)S(=O)(=O)C3=C(N(N=C3)C)C

InChI

InChI=1S/C19H30N4O5S/c1-4-28-19(25)16-8-5-9-22(12-16)18(24)15-7-6-10-23(13-15)29(26,27)17-11-20-21(3)14(17)2/h11,15-16H,4-10,12-13H2,1-3H3