2-[1-[methyl(octadecyl)carbamoyl]piperidin-2-yl]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[1-[methyl(octadecyl)carbamoyl]piperidin-2-yl]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[1-[methyl(octadecyl)carbamoyl]-2-piperidyl]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[1-[[methyl(octadecyl)amino]-oxomethyl]-2-piperidinyl]ethyl ester IUPAC Name: 2-[1-[methyl(octadecyl)carbamoyl]piperidin-2-yl]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[1-[methyl(stearyl)carbamoyl]-2-piperidyl]ethyl ester Formula: C34H60N2O4S MolecularWeight: 592.9162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN(C)C(=O)N1CCCCC1CCOS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN(C)C(=O)N1CCCCC1CCOS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C34H60N2O4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-28-35(3)34(37)36-29-21-19-22-32(36)27-30-40-41(38,39)33-25-23-31(2)24-26-33/h23-26,32H,4-22,27-30H2,1-3H3