N4-[(4-chlorophenyl)methyl]-N4-[(3-phenoxyphenyl)methyl]cyclohexane-1,4-diamine

Systemtic Name: N4-[(4-chlorophenyl)methyl]-N4-[(3-phenoxyphenyl)methyl]cyclohexane-1,4-diamine Openeye Name: N4-[(4-chlorophenyl)methyl]-N4-[(3-phenoxyphenyl)methyl]cyclohexane-1,4-diamine CAS Name: N4-[(4-chlorophenyl)methyl]-N4-[(3-phenoxyphenyl)methyl]cyclohexane-1,4-diamine IUPAC Name: 4-N-[(4-chlorophenyl)methyl]-4-N-[(3-phenoxyphenyl)methyl]cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-(4-chlorobenzyl)-(3-phenoxybenzyl)amine Formula: C26H29ClN2O MolecularWeight: 420.97426

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC2=CC=C(C=C2)Cl)CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CC(CCC1N)N(CC2=CC=C(C=C2)Cl)CC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H29ClN2O/c27-22-11-9-20(10-12-22)18-29(24-15-13-23(28)14-16-24)19-21-5-4-8-26(17-21)30-25-6-2-1-3-7-25/h1-12,17,23-24H,13-16,18-19,28H2