[2-[(4-chlorophenyl)methyl]-4-[2-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethyl]piperazin-1-yl]-[3-methyl-5-(trifluoromethyl)phenyl]methanone trihydrochloride

Systemtic Name: [2-[(4-chlorophenyl)methyl]-4-[2-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethyl]piperazin-1-yl]-[3-methyl-5-(trifluoromethyl)phenyl]methanone trihydrochloride Openeye Name: [2-[(4-chlorophenyl)methyl]-4-[2-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethyl]piperazin-1-yl]-[3-methyl-5-(trifluoromethyl)phenyl]methanone trihydrochloride CAS Name: [2-[(4-chlorophenyl)methyl]-4-[2-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethyl]-1-piperazinyl]-[3-methyl-5-(trifluoromethyl)phenyl]methanone trihydrochloride IUPAC Name: [2-[(4-chlorophenyl)methyl]-4-[2-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethyl]piperazin-1-yl]-[3-methyl-5-(trifluoromethyl)phenyl]methanone trihydrochloride Traditional Name: [2-(4-chlorobenzyl)-4-[2-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethyl]piperazino]-[3-methyl-5-(trifluoromethyl)phenyl]methanone trihydrochloride Formula: C30H35Cl4F3N4O MolecularWeight: 666.43231

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N2CCN(CC2CC3=CC=C(C=C3)Cl)CCN4CCC5=C(C4)C=CC=N5)C(F)(F)F.Cl.Cl.Cl

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCN(CC2CC3=CC=C(C=C3)Cl)CCN4CCC5=C(C4)C=CC=N5)C(F)(F)F.Cl.Cl.Cl

InChI

InChI=1S/C30H32ClF3N4O.3ClH/c1-21-15-24(18-25(16-21)30(32,33)34)29(39)38-14-13-37(20-27(38)17-22-4-6-26(31)7-5-22)12-11-36-10-8-28-23(19-36)3-2-9-35-28;;;/h2-7,9,15-16,18,27H,8,10-14,17,19-20H2,1H3;3*1H