2-(phenylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol chloride

Systemtic Name: 2-(phenylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol chloride Openeye Name: 2-benzyl-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol chloride CAS Name: 2-(phenylmethyl)-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol chloride IUPAC Name: 2-benzyl-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol chloride Traditional Name: 2-benzyl-1,2,3,4-tetrahydroisoquinolin-2-ium-4,6-diol chloride Formula: C16H18ClNO2 MolecularWeight: 291.77262

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C[NH+]1CC3=CC=CC=C3)C=CC(=C2)O)O.[Cl-]

Isomeric SMILES

C1C(C2=C(C[NH+]1CC3=CC=CC=C3)C=CC(=C2)O)O.[Cl-]

InChI

InChI=1S/C16H17NO2.ClH/c18-14-7-6-13-10-17(11-16(19)15(13)8-14)9-12-4-2-1-3-5-12;/h1-8,16,18-19H,9-11H2;1H