[1-(diethylamino)-3-pyrrolidin-1-yl-propan-2-yl] N-(3-heptoxyphenyl)carbamate hydrochloride

Systemtic Name: [1-(diethylamino)-3-pyrrolidin-1-yl-propan-2-yl] N-(3-heptoxyphenyl)carbamate hydrochloride Openeye Name: [1-(diethylaminomethyl)-2-pyrrolidin-1-yl-ethyl] N-(3-heptoxyphenyl)carbamate hydrochloride CAS Name: N-(3-heptoxyphenyl)carbamic acid [1-(diethylamino)-3-(1-pyrrolidinyl)propan-2-yl] ester hydrochloride IUPAC Name: [1-(diethylamino)-3-pyrrolidin-1-ylpropan-2-yl] N-(3-heptoxyphenyl)carbamate hydrochloride Traditional Name: N-(3-heptoxyphenyl)carbamic acid [1-(diethylaminomethyl)-2-pyrrolidino-ethyl] ester hydrochloride Formula: C25H44ClN3O3 MolecularWeight: 470.08816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=CC(=C1)NC(=O)OC(CN2CCCC2)CN(CC)CC.Cl

Isomeric SMILES

CCCCCCCOC1=CC=CC(=C1)NC(=O)OC(CN2CCCC2)CN(CC)CC.Cl

InChI

InChI=1S/C25H43N3O3.ClH/c1-4-7-8-9-12-18-30-23-15-13-14-22(19-23)26-25(29)31-24(20-27(5-2)6-3)21-28-16-10-11-17-28;/h13-15,19,24H,4-12,16-18,20-21H2,1-3H3,(H,26,29);1H