1,3-di(piperidin-1-yl)propan-2-yl N-(3-octoxyphenyl)carbamate dihydrochloride

Systemtic Name: 1,3-di(piperidin-1-yl)propan-2-yl N-(3-octoxyphenyl)carbamate dihydrochloride Openeye Name: [2-(1-piperidyl)-1-(1-piperidylmethyl)ethyl] N-(3-octoxyphenyl)carbamate dihydrochloride CAS Name: N-(3-octoxyphenyl)carbamic acid 1,3-bis(1-piperidinyl)propan-2-yl ester dihydrochloride IUPAC Name: 1,3-di(piperidin-1-yl)propan-2-yl N-(3-octoxyphenyl)carbamate dihydrochloride Traditional Name: N-(3-octoxyphenyl)carbamic acid [2-piperidino-1-(piperidinomethyl)ethyl] ester dihydrochloride Formula: C28H49Cl2N3O3 MolecularWeight: 546.61296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=CC(=C1)NC(=O)OC(CN2CCCCC2)CN3CCCCC3.Cl.Cl

Isomeric SMILES

CCCCCCCCOC1=CC=CC(=C1)NC(=O)OC(CN2CCCCC2)CN3CCCCC3.Cl.Cl

InChI

InChI=1S/C28H47N3O3.2ClH/c1-2-3-4-5-6-13-21-33-26-16-14-15-25(22-26)29-28(32)34-27(23-30-17-9-7-10-18-30)24-31-19-11-8-12-20-31;;/h14-16,22,27H,2-13,17-21,23-24H2,1H3,(H,29,32);2*1H