N1-[(4-fluorophenyl)methyl]-N3-methyl-N1-pyridin-2-yl-octane-1,3,8-triamine

Systemtic Name: N1-[(4-fluorophenyl)methyl]-N3-methyl-N1-pyridin-2-yl-octane-1,3,8-triamine Openeye Name: N1-[(4-fluorophenyl)methyl]-N3-methyl-N1-(2-pyridyl)octane-1,3,8-triamine CAS Name: N1-[(4-fluorophenyl)methyl]-N3-methyl-N1-(2-pyridinyl)octane-1,3,8-triamine IUPAC Name: 1-N-[(4-fluorophenyl)methyl]-3-N-methyl-1-N-pyridin-2-yloctane-1,3,8-triamine Traditional Name: [8-amino-3-(methylamino)octyl]-(4-fluorobenzyl)-(2-pyridyl)amine Formula: C21H31FN4 MolecularWeight: 358.496043

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CCCCCN)CCN(CC1=CC=C(C=C1)F)C2=CC=CC=N2

Isomeric SMILES

CNC(CCCCCN)CCN(CC1=CC=C(C=C1)F)C2=CC=CC=N2

InChI

InChI=1S/C21H31FN4/c1-24-20(7-3-2-5-14-23)13-16-26(21-8-4-6-15-25-21)17-18-9-11-19(22)12-10-18/h4,6,8-12,15,20,24H,2-3,5,7,13-14,16-17,23H2,1H3