(3R,4R)-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylic acid chloride

Systemtic Name: (3R,4R)-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylic acid chloride Openeye Name: (3R,4R)-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylic acid chloride CAS Name: (3R,4R)-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylic acid chloride IUPAC Name: (3R,4R)-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylic acid chloride Traditional Name: (3R,4R)-4-phenyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylic acid chloride Formula: C16H16ClNO2 MolecularWeight: 289.75674

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(C([NH2+]1)C(=O)O)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1C2=CC=CC=C2[C@H]([C@@H]([NH2+]1)C(=O)O)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C16H15NO2.ClH/c18-16(19)15-14(11-6-2-1-3-7-11)13-9-5-4-8-12(13)10-17-15;/h1-9,14-15,17H,10H2,(H,18,19);1H/t14-,15-;/m1./s1