4-(aminomethyl)-N-[1-[4-(4-methoxyphenyl)pyridin-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide

Systemtic Name: 4-(aminomethyl)-N-[1-[4-(4-methoxyphenyl)pyridin-2-yl]-2-phenyl-ethyl]cyclohexane-1-carboxamide Openeye Name: 4-(aminomethyl)-N-[1-[4-(4-methoxyphenyl)-2-pyridyl]-2-phenyl-ethyl]cyclohexanecarboxamide CAS Name: 4-(aminomethyl)-N-[1-[4-(4-methoxyphenyl)-2-pyridinyl]-2-phenylethyl]-1-cyclohexanecarboxamide IUPAC Name: 4-(aminomethyl)-N-[1-[4-(4-methoxyphenyl)pyridin-2-yl]-2-phenylethyl]cyclohexane-1-carboxamide Traditional Name: 4-(aminomethyl)-N-[1-[4-(4-methoxyphenyl)-2-pyridyl]-2-phenyl-ethyl]cyclohexanecarboxamide Formula: C28H33N3O2 MolecularWeight: 443.58052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC=C2)C(CC3=CC=CC=C3)NC(=O)C4CCC(CC4)CN

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC=C2)C(CC3=CC=CC=C3)NC(=O)C4CCC(CC4)CN

InChI

InChI=1S/C28H33N3O2/c1-33-25-13-11-22(12-14-25)24-15-16-30-26(18-24)27(17-20-5-3-2-4-6-20)31-28(32)23-9-7-21(19-29)8-10-23/h2-6,11-16,18,21,23,27H,7-10,17,19,29H2,1H3,(H,31,32)