N-[[2-(azocan-1-yl)pyridin-3-yl]methyl]-1-(4-fluoranyl-3-methoxy-phenyl)methanamine

Systemtic Name: N-[[2-(azocan-1-yl)pyridin-3-yl]methyl]-1-(4-fluoranyl-3-methoxy-phenyl)methanamine Openeye Name: N-[[2-(azocan-1-yl)-3-pyridyl]methyl]-1-(4-fluoro-3-methoxy-phenyl)methanamine CAS Name: N-[[2-(1-azocanyl)-3-pyridinyl]methyl]-1-(4-fluoro-3-methoxyphenyl)methanamine IUPAC Name: N-[[2-(azocan-1-yl)pyridin-3-yl]methyl]-1-(4-fluoro-3-methoxyphenyl)methanamine Traditional Name: [2-(azocan-1-yl)-3-pyridyl]methyl-(4-fluoro-3-methoxy-benzyl)amine Formula: C21H28FN3O MolecularWeight: 357.464923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNCC2=C(N=CC=C2)N3CCCCCCC3)F

Isomeric SMILES

COC1=C(C=CC(=C1)CNCC2=C(N=CC=C2)N3CCCCCCC3)F

InChI

InChI=1S/C21H28FN3O/c1-26-20-14-17(9-10-19(20)22)15-23-16-18-8-7-11-24-21(18)25-12-5-3-2-4-6-13-25/h7-11,14,23H,2-6,12-13,15-16H2,1H3