3-(azepan-4-yl)-2-chloranyl-6-methyl-7-[[3-(trifluoromethyl)phenoxy]methyl]quinoline

Systemtic Name: 3-(azepan-4-yl)-2-chloranyl-6-methyl-7-[[3-(trifluoromethyl)phenoxy]methyl]quinoline Openeye Name: 3-(azepan-4-yl)-2-chloro-6-methyl-7-[[3-(trifluoromethyl)phenoxy]methyl]quinoline CAS Name: 3-(4-azepanyl)-2-chloro-6-methyl-7-[[3-(trifluoromethyl)phenoxy]methyl]quinoline IUPAC Name: 3-(azepan-4-yl)-2-chloro-6-methyl-7-[[3-(trifluoromethyl)phenoxy]methyl]quinoline Traditional Name: 3-(azepan-4-yl)-2-chloro-6-methyl-7-[[3-(trifluoromethyl)phenoxy]methyl]quinoline Formula: C24H24ClF3N2O MolecularWeight: 448.90837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1COC3=CC=CC(=C3)C(F)(F)F)Cl)C4CCCNCC4

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1COC3=CC=CC(=C3)C(F)(F)F)Cl)C4CCCNCC4

InChI

InChI=1S/C24H24ClF3N2O/c1-15-10-17-11-21(16-4-3-8-29-9-7-16)23(25)30-22(17)12-18(15)14-31-20-6-2-5-19(13-20)24(26,27)28/h2,5-6,10-13,16,29H,3-4,7-9,14H2,1H3