3-[methyl-(phenylmethyl)amino]propyl carbonate hydrate dihydrochloride

Systemtic Name: 3-[methyl-(phenylmethyl)amino]propyl carbonate hydrate dihydrochloride Openeye Name: 3-[benzyl(methyl)amino]propyl carbonate hydrate dihydrochloride CAS Name: 3-[methyl-(phenylmethyl)amino]propyl carbonate hydrate dihydrochloride IUPAC Name: 3-[benzyl(methyl)amino]propyl carbonate hydrate dihydrochloride Traditional Name: 3-[benzyl(methyl)amino]propyl carbonate hydrate dihydrochloride Formula: C12H20Cl2NO4- MolecularWeight: 313.1975

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCOC(=O)[O-])CC1=CC=CC=C1.O.Cl.Cl

Isomeric SMILES

CN(CCCOC(=O)[O-])CC1=CC=CC=C1.O.Cl.Cl

InChI

InChI=1S/C12H17NO3.2ClH.H2O/c1-13(8-5-9-16-12(14)15)10-11-6-3-2-4-7-11;;;/h2-4,6-7H,5,8-10H2,1H3,(H,14,15);2*1H;1H2/p-1