4-[[4-[[3-(4-chloranylphenoxy)phenyl]methylamino]-3-methyl-cyclohexyl]methyl]-2-methyl-cyclohexan-1-amine

Systemtic Name: 4-[[4-[[3-(4-chloranylphenoxy)phenyl]methylamino]-3-methyl-cyclohexyl]methyl]-2-methyl-cyclohexan-1-amine Openeye Name: 4-[[4-[[3-(4-chlorophenoxy)phenyl]methylamino]-3-methyl-cyclohexyl]methyl]-2-methyl-cyclohexanamine CAS Name: 4-[[4-[[3-(4-chlorophenoxy)phenyl]methylamino]-3-methylcyclohexyl]methyl]-2-methyl-1-cyclohexanamine IUPAC Name: 4-[[4-[[3-(4-chlorophenoxy)phenyl]methylamino]-3-methylcyclohexyl]methyl]-2-methylcyclohexan-1-amine Traditional Name: [4-[(4-amino-3-methyl-cyclohexyl)methyl]-2-methyl-cyclohexyl]-[3-(4-chlorophenoxy)benzyl]amine Formula: C28H39ClN2O MolecularWeight: 455.07506

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CCC1N)CC2CCC(C(C2)C)NCC3=CC(=CC=C3)OC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1CC(CCC1N)CC2CCC(C(C2)C)NCC3=CC(=CC=C3)OC4=CC=C(C=C4)Cl

InChI

InChI=1S/C28H39ClN2O/c1-19-14-21(6-12-27(19)30)16-22-7-13-28(20(2)15-22)31-18-23-4-3-5-26(17-23)32-25-10-8-24(29)9-11-25/h3-5,8-11,17,19-22,27-28,31H,6-7,12-16,18,30H2,1-2H3