[1-[(3aR,5R,6S,6aR)-6-dodecoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-piperidin-1-yl-ethyl] N-(4-methylphenyl)sulfonylcarbamate hydrochloride

Systemtic Name: [1-[(3aR,5R,6S,6aR)-6-dodecoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-piperidin-1-yl-ethyl] N-(4-methylphenyl)sulfonylcarbamate hydrochloride Openeye Name: [1-[(3aR,5R,6S,6aR)-6-dodecoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-(1-piperidyl)ethyl] N-(p-tolylsulfonyl)carbamate hydrochloride CAS Name: N-(4-methylphenyl)sulfonylcarbamic acid [1-[(3aR,5R,6S,6aR)-6-dodecoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-(1-piperidinyl)ethyl] ester hydrochloride IUPAC Name: [1-[(3aR,5R,6S,6aR)-6-dodecoxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-piperidin-1-ylethyl] N-(4-methylphenyl)sulfonylcarbamate hydrochloride Traditional Name: N-tosylcarbamic acid [1-[(3aR,5R,6S,6aR)-6-lauryloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-piperidino-ethyl] ester hydrochloride Formula: C34H57ClN2O8S MolecularWeight: 689.34298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1C2C(OC1C(CN3CCCCC3)OC(=O)NS(=O)(=O)C4=CC=C(C=C4)C)OC(O2)(C)C.Cl

Isomeric SMILES

CCCCCCCCCCCCO[C@@H]1[C@@H]2[C@H](O[C@@H]1C(CN3CCCCC3)OC(=O)NS(=O)(=O)C4=CC=C(C=C4)C)OC(O2)(C)C.Cl

InChI

InChI=1S/C34H56N2O8S.ClH/c1-5-6-7-8-9-10-11-12-13-17-24-40-30-29(42-32-31(30)43-34(3,4)44-32)28(25-36-22-15-14-16-23-36)41-33(37)35-45(38,39)27-20-18-26(2)19-21-27;/h18-21,28-32H,5-17,22-25H2,1-4H3,(H,35,37);1H/t28?,29-,30+,31-,32-;/m1./s1