2-[1-[3-(dimethylamino)propyl]piperidin-2-yl]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[1-[3-(dimethylamino)propyl]piperidin-2-yl]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[1-[3-(dimethylamino)propyl]-2-piperidyl]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[1-[3-(dimethylamino)propyl]-2-piperidinyl]ethyl ester IUPAC Name: 2-[1-[3-(dimethylamino)propyl]piperidin-2-yl]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[1-[3-(dimethylamino)propyl]-2-piperidyl]ethyl ester Formula: C19H32N2O3S MolecularWeight: 368.53398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC2CCCCN2CCCN(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC2CCCCN2CCCN(C)C

InChI

InChI=1S/C19H32N2O3S/c1-17-8-10-19(11-9-17)25(22,23)24-16-12-18-7-4-5-14-21(18)15-6-13-20(2)3/h8-11,18H,4-7,12-16H2,1-3H3