[4-[[(3-methylphenyl)methyl-[(3-phenoxyphenyl)methyl]amino]methyl]cyclohexyl]methanamine

Systemtic Name: [4-[[(3-methylphenyl)methyl-[(3-phenoxyphenyl)methyl]amino]methyl]cyclohexyl]methanamine Openeye Name: [4-[[m-tolylmethyl-[(3-phenoxyphenyl)methyl]amino]methyl]cyclohexyl]methanamine CAS Name: [4-[[(3-methylphenyl)methyl-[(3-phenoxyphenyl)methyl]amino]methyl]cyclohexyl]methanamine IUPAC Name: [4-[[(3-methylphenyl)methyl-[(3-phenoxyphenyl)methyl]amino]methyl]cyclohexyl]methanamine Traditional Name: [4-(aminomethyl)cyclohexyl]methyl-(3-methylbenzyl)-(3-phenoxybenzyl)amine Formula: C29H36N2O MolecularWeight: 428.60894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN(CC2CCC(CC2)CN)CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CN(CC2CCC(CC2)CN)CC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C29H36N2O/c1-23-7-5-8-26(17-23)21-31(20-25-15-13-24(19-30)14-16-25)22-27-9-6-12-29(18-27)32-28-10-3-2-4-11-28/h2-12,17-18,24-25H,13-16,19-22,30H2,1H3