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

Systemtic Name: [4-[[(3-phenoxyphenyl)methyl-(pyridin-3-ylmethyl)amino]methyl]cyclohexyl]methanamine Openeye Name: [4-[[(3-phenoxyphenyl)methyl-(3-pyridylmethyl)amino]methyl]cyclohexyl]methanamine CAS Name: [4-[[(3-phenoxyphenyl)methyl-(3-pyridinylmethyl)amino]methyl]cyclohexyl]methanamine IUPAC Name: [4-[[(3-phenoxyphenyl)methyl-(pyridin-3-ylmethyl)amino]methyl]cyclohexyl]methanamine Traditional Name: [4-(aminomethyl)cyclohexyl]methyl-(3-phenoxybenzyl)-(3-pyridylmethyl)amine Formula: C27H33N3O MolecularWeight: 415.57042

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN)CN(CC2=CC(=CC=C2)OC3=CC=CC=C3)CC4=CN=CC=C4

Isomeric SMILES

C1CC(CCC1CN)CN(CC2=CC(=CC=C2)OC3=CC=CC=C3)CC4=CN=CC=C4

InChI

InChI=1S/C27H33N3O/c28-17-22-11-13-23(14-12-22)19-30(21-25-7-5-15-29-18-25)20-24-6-4-10-27(16-24)31-26-8-2-1-3-9-26/h1-10,15-16,18,22-23H,11-14,17,19-21,28H2