2-[3-(methylamino)-1-phenyl-propoxy]-4-(trifluoromethyl)benzenecarbonitrile hydrochloride

Systemtic Name: 2-[3-(methylamino)-1-phenyl-propoxy]-4-(trifluoromethyl)benzenecarbonitrile hydrochloride Openeye Name: 2-[3-(methylamino)-1-phenyl-propoxy]-4-(trifluoromethyl)benzonitrile hydrochloride CAS Name: 2-[3-(methylamino)-1-phenylpropoxy]-4-(trifluoromethyl)benzonitrile hydrochloride IUPAC Name: 2-[3-(methylamino)-1-phenylpropoxy]-4-(trifluoromethyl)benzonitrile hydrochloride Traditional Name: 2-[3-(methylamino)-1-phenyl-propoxy]-4-(trifluoromethyl)benzonitrile hydrochloride Formula: C18H18ClF3N2O MolecularWeight: 370.79653

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC(C1=CC=CC=C1)OC2=C(C=CC(=C2)C(F)(F)F)C#N.Cl

Isomeric SMILES

CNCCC(C1=CC=CC=C1)OC2=C(C=CC(=C2)C(F)(F)F)C#N.Cl

InChI

InChI=1S/C18H17F3N2O.ClH/c1-23-10-9-16(13-5-3-2-4-6-13)24-17-11-15(18(19,20)21)8-7-14(17)12-22;/h2-8,11,16,23H,9-10H2,1H3;1H