ethyl 4-[4-(phenylsulfonylaminomethyl)cyclohexyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-(phenylsulfonylaminomethyl)cyclohexyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-(benzenesulfonamidomethyl)cyclohexanecarbonyl]piperazine-1-carboxylate CAS Name: 4-[[4-(benzenesulfonamidomethyl)cyclohexyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(benzenesulfonamidomethyl)cyclohexanecarbonyl]piperazine-1-carboxylate Traditional Name: 4-[4-(benzenesulfonamidomethyl)cyclohexanecarbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CCC(CC2)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CCC(CC2)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H31N3O5S/c1-2-29-21(26)24-14-12-23(13-15-24)20(25)18-10-8-17(9-11-18)16-22-30(27,28)19-6-4-3-5-7-19/h3-7,17-18,22H,2,8-16H2,1H3