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

Systemtic Name: 1-[(4-ethylphenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Openeye Name: 1-[(4-ethylphenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane CAS Name: 1-[(4-ethylphenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane IUPAC Name: 1-[(4-ethylphenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Traditional Name: 1-[(4-ethylphenyl)-[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Formula: C21H25F3N2 MolecularWeight: 362.43181

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC(=CC=C2)C(F)(F)F)N3CCCNCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC(=CC=C2)C(F)(F)F)N3CCCNCC3

InChI

InChI=1S/C21H25F3N2/c1-2-16-7-9-17(10-8-16)20(26-13-4-11-25-12-14-26)18-5-3-6-19(15-18)21(22,23)24/h3,5-10,15,20,25H,2,4,11-14H2,1H3