[(1S,2S)-2-(pyrrolidin-1-ylmethyl)cyclohexyl] N-(3-pentoxyphenyl)carbamate hydrochloride

Systemtic Name: [(1S,2S)-2-(pyrrolidin-1-ylmethyl)cyclohexyl] N-(3-pentoxyphenyl)carbamate hydrochloride Openeye Name: [(1S,2S)-2-(pyrrolidin-1-ylmethyl)cyclohexyl] N-(3-pentoxyphenyl)carbamate hydrochloride CAS Name: N-(3-pentoxyphenyl)carbamic acid [(1S,2S)-2-(1-pyrrolidinylmethyl)cyclohexyl] ester hydrochloride IUPAC Name: [(1S,2S)-2-(pyrrolidin-1-ylmethyl)cyclohexyl] N-(3-pentoxyphenyl)carbamate hydrochloride Traditional Name: N-(3-amoxyphenyl)carbamic acid [(1S,2S)-2-(pyrrolidinomethyl)cyclohexyl] ester hydrochloride Formula: C23H37ClN2O3 MolecularWeight: 425.00448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)NC(=O)OC2CCCCC2CN3CCCC3.Cl

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)NC(=O)O[C@H]2CCCC[C@H]2CN3CCCC3.Cl

InChI

InChI=1S/C23H36N2O3.ClH/c1-2-3-8-16-27-21-12-9-11-20(17-21)24-23(26)28-22-13-5-4-10-19(22)18-25-14-6-7-15-25;/h9,11-12,17,19,22H,2-8,10,13-16,18H2,1H3,(H,24,26);1H/t19-,22-;/m0./s1