phenyl N-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]carbamate

Systemtic Name: phenyl N-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]carbamate Openeye Name: phenyl N-[2-[1-(p-tolylsulfonyl)-2-piperidyl]ethyl]carbamate CAS Name: N-[2-[1-(4-methylphenyl)sulfonyl-2-piperidinyl]ethyl]carbamic acid phenyl ester IUPAC Name: phenyl N-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]carbamate Traditional Name: N-[2-(1-tosyl-2-piperidyl)ethyl]carbamic acid phenyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2CCNC(=O)OC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2CCNC(=O)OC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O4S/c1-17-10-12-20(13-11-17)28(25,26)23-16-6-5-7-18(23)14-15-22-21(24)27-19-8-3-2-4-9-19/h2-4,8-13,18H,5-7,14-16H2,1H3,(H,22,24)