butan-2-yl 2-[3-oxidanylidene-1-(phenylsulfonyl)piperazin-2-yl]ethanoate

Systemtic Name: butan-2-yl 2-[3-oxidanylidene-1-(phenylsulfonyl)piperazin-2-yl]ethanoate Openeye Name: sec-butyl 2-[1-(benzenesulfonyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-(benzenesulfonyl)-3-oxo-2-piperazinyl]acetic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-[1-(benzenesulfonyl)-3-oxopiperazin-2-yl]acetate Traditional Name: 2-(1-besyl-3-keto-piperazin-2-yl)acetic acid sec-butyl ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CC1C(=O)NCCN1S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(C)OC(=O)CC1C(=O)NCCN1S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H22N2O5S/c1-3-12(2)23-15(19)11-14-16(20)17-9-10-18(14)24(21,22)13-7-5-4-6-8-13/h4-8,12,14H,3,9-11H2,1-2H3,(H,17,20)