1-(4-chlorophenyl)-N1,N1,N4-trimethyl-N4-prop-2-enyl-cyclohexane-1,4-diamine hydrate dihydrochloride

Systemtic Name: 1-(4-chlorophenyl)-N1,N1,N4-trimethyl-N4-prop-2-enyl-cyclohexane-1,4-diamine hydrate dihydrochloride Openeye Name: N4-allyl-1-(4-chlorophenyl)-N1,N1,N4-trimethyl-cyclohexane-1,4-diamine hydrate dihydrochloride CAS Name: 1-(4-chlorophenyl)-N1,N1,N4-trimethyl-N4-prop-2-enylcyclohexane-1,4-diamine hydrate dihydrochloride IUPAC Name: 1-(4-chlorophenyl)-1-N,1-N,4-N-trimethyl-4-N-prop-2-enylcyclohexane-1,4-diamine hydrate dihydrochloride Traditional Name: allyl-[4-(4-chlorophenyl)-4-(dimethylamino)cyclohexyl]-methyl-amine hydrate dihydrochloride Formula: C18H31Cl3N2O MolecularWeight: 397.81054

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCC(CC1)N(C)CC=C)C2=CC=C(C=C2)Cl.O.Cl.Cl

Isomeric SMILES

CN(C)C1(CCC(CC1)N(C)CC=C)C2=CC=C(C=C2)Cl.O.Cl.Cl

InChI

InChI=1S/C18H27ClN2.2ClH.H2O/c1-5-14-21(4)17-10-12-18(13-11-17,20(2)3)15-6-8-16(19)9-7-15;;;/h5-9,17H,1,10-14H2,2-4H3;2*1H;1H2