methyl 2-[1-(3-chloranyl-2-methyl-phenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-(3-chloranyl-2-methyl-phenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-(3-chloro-2-methyl-phenyl)sulfonyl-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-(3-chloro-2-methylphenyl)sulfonyl-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(3-chloro-2-methylphenyl)sulfonyl-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-(3-chloro-2-methyl-phenyl)sulfonyl-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C14H17ClN2O5S MolecularWeight: 360.81318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)S(=O)(=O)N2CCNC(=O)C2CC(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1Cl)S(=O)(=O)N2CCNC(=O)C2CC(=O)OC

InChI

InChI=1S/C14H17ClN2O5S/c1-9-10(15)4-3-5-12(9)23(20,21)17-7-6-16-14(19)11(17)8-13(18)22-2/h3-5,11H,6-8H2,1-2H3,(H,16,19)