1-(4-chlorophenyl)-6-fluoranyl-N,N-dimethyl-1,4-dihydroisoquinolin-3-amine hydrate hydrochloride

Systemtic Name: 1-(4-chlorophenyl)-6-fluoranyl-N,N-dimethyl-1,4-dihydroisoquinolin-3-amine hydrate hydrochloride Openeye Name: 1-(4-chlorophenyl)-6-fluoro-N,N-dimethyl-1,4-dihydroisoquinolin-3-amine hydrate hydrochloride CAS Name: 1-(4-chlorophenyl)-6-fluoro-N,N-dimethyl-1,4-dihydroisoquinolin-3-amine hydrate hydrochloride IUPAC Name: 1-(4-chlorophenyl)-6-fluoro-N,N-dimethyl-1,4-dihydroisoquinolin-3-amine hydrate hydrochloride Traditional Name: [1-(4-chlorophenyl)-6-fluoro-1,4-dihydroisoquinolin-3-yl]-dimethyl-amine hydrate hydrochloride Formula: C17H19Cl2FN2O MolecularWeight: 357.249963

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(C2=C(C1)C=C(C=C2)F)C3=CC=C(C=C3)Cl.O.Cl

Isomeric SMILES

CN(C)C1=NC(C2=C(C1)C=C(C=C2)F)C3=CC=C(C=C3)Cl.O.Cl

InChI

InChI=1S/C17H16ClFN2.ClH.H2O/c1-21(2)16-10-12-9-14(19)7-8-15(12)17(20-16)11-3-5-13(18)6-4-11;;/h3-9,17H,10H2,1-2H3;1H;1H2