ethyl 4-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[(3S)-1-(phenylsulfonyl)piperidin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[(3S)-1-(benzenesulfonyl)piperidine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[(3S)-1-(benzenesulfonyl)-3-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(3S)-1-(benzenesulfonyl)piperidine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[(3S)-1-besylnipecotoyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H27N3O5S MolecularWeight: 409.49978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H27N3O5S/c1-2-27-19(24)21-13-11-20(12-14-21)18(23)16-7-6-10-22(15-16)28(25,26)17-8-4-3-5-9-17/h3-5,8-9,16H,2,6-7,10-15H2,1H3/t16-/m0/s1