2-[(1R)-2-(2-chloranylethanoyl)-3,4-dihydro-1H-isoquinolin-1-yl]-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[(1R)-2-(2-chloranylethanoyl)-3,4-dihydro-1H-isoquinolin-1-yl]-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 2-[(1R)-2-(2-chloroacetyl)-3,4-dihydro-1H-isoquinolin-1-yl]-3-hydroxy-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-[(1R)-2-(2-chloro-1-oxoethyl)-3,4-dihydro-1H-isoquinolin-1-yl]-3-hydroxy-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-[(1R)-2-(2-chloroacetyl)-3,4-dihydro-1H-isoquinolin-1-yl]-3-hydroxy-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 2-[(1R)-2-(2-chloroacetyl)-3,4-dihydro-1H-isoquinolin-1-yl]-3-hydroxy-5,5-dimethyl-cyclohex-2-en-1-one Formula: C19H22ClNO3 MolecularWeight: 347.83588

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C2C3=CC=CC=C3CCN2C(=O)CCl)O)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)[C@H]2C3=CC=CC=C3CCN2C(=O)CCl)O)C

InChI

InChI=1S/C19H22ClNO3/c1-19(2)9-14(22)17(15(23)10-19)18-13-6-4-3-5-12(13)7-8-21(18)16(24)11-20/h3-6,18,22H,7-11H2,1-2H3/t18-/m1/s1