2-(phenylmethyl)-1,3,4,7,8,8a-hexahydroisoquinolin-6-one chloride

Systemtic Name: 2-(phenylmethyl)-1,3,4,7,8,8a-hexahydroisoquinolin-6-one chloride Openeye Name: 2-benzyl-1,3,4,7,8,8a-hexahydroisoquinolin-6-one chloride CAS Name: 2-(phenylmethyl)-1,3,4,7,8,8a-hexahydroisoquinolin-6-one chloride IUPAC Name: 2-benzyl-1,3,4,7,8,8a-hexahydroisoquinolin-6-one chloride Traditional Name: 2-benzyl-1,3,4,7,8,8a-hexahydroisoquinolin-6-one chloride Formula: C16H19ClNO- MolecularWeight: 276.78116

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C=C2C1CN(CC2)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1CC(=O)C=C2C1CN(CC2)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C16H19NO.ClH/c18-16-7-6-15-12-17(9-8-14(15)10-16)11-13-4-2-1-3-5-13;/h1-5,10,15H,6-9,11-12H2;1H/p-1