1-(4-methylphenyl)-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-4a-ol chloride

Systemtic Name: 1-(4-methylphenyl)-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-4a-ol chloride Openeye Name: 1-(p-tolyl)-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-4a-ol chloride CAS Name: 1-(4-methylphenyl)-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-4a-ol chloride IUPAC Name: 1-(4-methylphenyl)-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-4a-ol chloride Traditional Name: 1-(p-tolyl)-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-2-ium-4a-ol chloride Formula: C16H24ClNO MolecularWeight: 281.82086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3CCCCC3(CC[NH2+]2)O.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)C2C3CCCCC3(CC[NH2+]2)O.[Cl-]

InChI

InChI=1S/C16H23NO.ClH/c1-12-5-7-13(8-6-12)15-14-4-2-3-9-16(14,18)10-11-17-15;/h5-8,14-15,17-18H,2-4,9-11H2,1H3;1H