methyl 4-cyclohexylcarbonyl-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxylate

Systemtic Name: methyl 4-cyclohexylcarbonyl-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxylate Openeye Name: methyl 4-(cyclohexanecarbonyl)-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxylate CAS Name: 4-[cyclohexyl(oxo)methyl]-1-(4-methoxyphenyl)sulfonyl-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 4-(cyclohexanecarbonyl)-1-(4-methoxyphenyl)sulfonylpiperazine-2-carboxylate Traditional Name: 4-(cyclohexanecarbonyl)-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxylic acid methyl ester Formula: C20H28N2O6S MolecularWeight: 424.51112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)OC)C(=O)C3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)OC)C(=O)C3CCCCC3

InChI

InChI=1S/C20H28N2O6S/c1-27-16-8-10-17(11-9-16)29(25,26)22-13-12-21(14-18(22)20(24)28-2)19(23)15-6-4-3-5-7-15/h8-11,15,18H,3-7,12-14H2,1-2H3