3-butyl-1-(4-chlorophenyl)-N1,N1,N4-trimethyl-N4-phenethyl-cyclohexane-1,4-diamine

Systemtic Name: 3-butyl-1-(4-chlorophenyl)-N1,N1,N4-trimethyl-N4-phenethyl-cyclohexane-1,4-diamine Openeye Name: 3-butyl-1-(4-chlorophenyl)-N1,N1,N4-trimethyl-N4-phenethyl-cyclohexane-1,4-diamine CAS Name: 3-butyl-1-(4-chlorophenyl)-N1,N1,N4-trimethyl-N4-phenethylcyclohexane-1,4-diamine IUPAC Name: 3-butyl-1-(4-chlorophenyl)-1-N,1-N,4-N-trimethyl-4-N-phenethylcyclohexane-1,4-diamine Traditional Name: [2-butyl-4-(4-chlorophenyl)-4-(dimethylamino)cyclohexyl]-methyl-phenethyl-amine Formula: C27H39ClN2 MolecularWeight: 427.06496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(CCC1N(C)CCC2=CC=CC=C2)(C3=CC=C(C=C3)Cl)N(C)C

Isomeric SMILES

CCCCC1CC(CCC1N(C)CCC2=CC=CC=C2)(C3=CC=C(C=C3)Cl)N(C)C

InChI

InChI=1S/C27H39ClN2/c1-5-6-12-23-21-27(29(2)3,24-13-15-25(28)16-14-24)19-17-26(23)30(4)20-18-22-10-8-7-9-11-22/h7-11,13-16,23,26H,5-6,12,17-21H2,1-4H3