3-(3-phenylpropyl)-4-(trifluoromethyl)isoquinoline

Systemtic Name: 3-(3-phenylpropyl)-4-(trifluoromethyl)isoquinoline Openeye Name: 3-(3-phenylpropyl)-4-(trifluoromethyl)isoquinoline CAS Name: 3-(3-phenylpropyl)-4-(trifluoromethyl)isoquinoline IUPAC Name: 3-(3-phenylpropyl)-4-(trifluoromethyl)isoquinoline Traditional Name: 3-(3-phenylpropyl)-4-(trifluoromethyl)isoquinoline Formula: C19H16F3N MolecularWeight: 315.33225

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC2=C(C3=CC=CC=C3C=N2)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCCC2=C(C3=CC=CC=C3C=N2)C(F)(F)F

InChI

InChI=1S/C19H16F3N/c20-19(21,22)18-16-11-5-4-10-15(16)13-23-17(18)12-6-9-14-7-2-1-3-8-14/h1-5,7-8,10-11,13H,6,9,12H2