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

Systemtic Name: 1-[(3-methylphenyl)-[2-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Openeye Name: 1-[m-tolyl-[2-(trifluoromethyl)phenyl]methyl]-1,4-diazepane CAS Name: 1-[(3-methylphenyl)-[2-(trifluoromethyl)phenyl]methyl]-1,4-diazepane IUPAC Name: 1-[(3-methylphenyl)-[2-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Traditional Name: 1-[m-tolyl-[2-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Formula: C20H23F3N2 MolecularWeight: 348.40523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=CC=C2C(F)(F)F)N3CCCNCC3

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=CC=C2C(F)(F)F)N3CCCNCC3

InChI

InChI=1S/C20H23F3N2/c1-15-6-4-7-16(14-15)19(25-12-5-10-24-11-13-25)17-8-2-3-9-18(17)20(21,22)23/h2-4,6-9,14,19,24H,5,10-13H2,1H3