N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-2-methyl-butan-1-amine

Systemtic Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-2-methyl-butan-1-amine Openeye Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-2-methyl-butan-1-amine CAS Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-2-methyl-1-butanamine IUPAC Name: N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-2-methylbutan-1-amine Traditional Name: [4-(aminomethyl)cyclohexyl]methyl-(4-benzoxy-3-methoxy-benzyl)-(2-methylbutyl)amine Formula: C28H42N2O2 MolecularWeight: 438.64528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN(CC1CCC(CC1)CN)CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

Isomeric SMILES

CCC(C)CN(CC1CCC(CC1)CN)CC2=CC(=C(C=C2)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C28H42N2O2/c1-4-22(2)18-30(19-24-12-10-23(17-29)11-13-24)20-26-14-15-27(28(16-26)31-3)32-21-25-8-6-5-7-9-25/h5-9,14-16,22-24H,4,10-13,17-21,29H2,1-3H3