ethyl 4-[3-[2-(4-chlorophenyl)ethylcarbamoyl]piperidin-1-yl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[2-(4-chlorophenyl)ethylcarbamoyl]piperidin-1-yl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[[3-[2-(4-chlorophenyl)ethylcarbamoyl]-1-piperidyl]sulfonyl]piperazine-1-carboxylate CAS Name: 4-[[3-[[2-(4-chlorophenyl)ethylamino]-oxomethyl]-1-piperidinyl]sulfonyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[2-(4-chlorophenyl)ethylcarbamoyl]piperidin-1-yl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[3-[2-(4-chlorophenyl)ethylcarbamoyl]piperidino]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C21H31ClN4O5S MolecularWeight: 487.01264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)N2CCCC(C2)C(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H31ClN4O5S/c1-2-31-21(28)24-12-14-25(15-13-24)32(29,30)26-11-3-4-18(16-26)20(27)23-10-9-17-5-7-19(22)8-6-17/h5-8,18H,2-4,9-16H2,1H3,(H,23,27)