N4-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N4-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine

Systemtic Name: N4-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N4-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine Openeye Name: N4-[(4-benzyloxy-3-methoxy-phenyl)methyl]-N4-(3-pyridylmethyl)cyclohexane-1,4-diamine CAS Name: N4-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N4-(3-pyridinylmethyl)cyclohexane-1,4-diamine IUPAC Name: 4-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-N-(pyridin-3-ylmethyl)cyclohexane-1,4-diamine Traditional Name: (4-aminocyclohexyl)-(4-benzoxy-3-methoxy-benzyl)-(3-pyridylmethyl)amine Formula: C27H33N3O2 MolecularWeight: 431.56982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(CC2=CN=CC=C2)C3CCC(CC3)N)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)CN(CC2=CN=CC=C2)C3CCC(CC3)N)OCC4=CC=CC=C4

InChI

InChI=1S/C27H33N3O2/c1-31-27-16-22(9-14-26(27)32-20-21-6-3-2-4-7-21)18-30(19-23-8-5-15-29-17-23)25-12-10-24(28)11-13-25/h2-9,14-17,24-25H,10-13,18-20,28H2,1H3