1-[(3-methylpyridin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane

Systemtic Name: 1-[(3-methylpyridin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Openeye Name: 1-[(3-methyl-2-pyridyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane CAS Name: 1-[(3-methyl-2-pyridinyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane IUPAC Name: 1-[(3-methylpyridin-2-yl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Traditional Name: 1-[(3-methyl-2-pyridyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Formula: C19H22F3N3 MolecularWeight: 349.39329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C(C2=CC(=CC=C2)C(F)(F)F)N3CCCNCC3

Isomeric SMILES

CC1=C(N=CC=C1)C(C2=CC(=CC=C2)C(F)(F)F)N3CCCNCC3

InChI

InChI=1S/C19H22F3N3/c1-14-5-3-9-24-17(14)18(25-11-4-8-23-10-12-25)15-6-2-7-16(13-15)19(20,21)22/h2-3,5-7,9,13,18,23H,4,8,10-12H2,1H3