2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one

Systemtic Name: 2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one Openeye Name: 2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one CAS Name: 2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one IUPAC Name: 2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one Traditional Name: 2,2-dimethyl-8-phenyl-1,3,4,7,8,8a-hexahydroisoquinolin-2-ium-6-one Formula: C17H22NO+ MolecularWeight: 256.36268

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2=CC(=O)CC(C2C1)C3=CC=CC=C3)C

Isomeric SMILES

C[N+]1(CCC2=CC(=O)CC(C2C1)C3=CC=CC=C3)C

InChI

InChI=1S/C17H22NO/c1-18(2)9-8-14-10-15(19)11-16(17(14)12-18)13-6-4-3-5-7-13/h3-7,10,16-17H,8-9,11-12H2,1-2H3/q+1