ethyl 4-[2-[(4-chlorophenyl)sulfonyl-cyclohexyl-amino]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(4-chlorophenyl)sulfonyl-cyclohexyl-amino]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(4-chlorophenyl)sulfonyl-cyclohexyl-amino]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(4-chlorophenyl)sulfonyl-cyclohexylamino]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-chlorophenyl)sulfonyl-cyclohexylamino]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(4-chlorophenyl)sulfonyl-cyclohexyl-amino]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H30ClN3O5S MolecularWeight: 471.998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CN(C2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CN(C2CCCCC2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H30ClN3O5S/c1-2-30-21(27)24-14-12-23(13-15-24)20(26)16-25(18-6-4-3-5-7-18)31(28,29)19-10-8-17(22)9-11-19/h8-11,18H,2-7,12-16H2,1H3