(2R)-2-(4-chloranyl-3,5-dimethyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one

Systemtic Name: (2R)-2-(4-chloranyl-3,5-dimethyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Openeye Name: (2R)-2-(4-chloro-3,5-dimethyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one CAS Name: (2R)-2-(4-chloro-3,5-dimethylphenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-propanone IUPAC Name: (2R)-2-(4-chloro-3,5-dimethylphenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Traditional Name: (2R)-2-(4-chloro-3,5-dimethyl-phenoxy)-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Formula: C20H22ClNO2 MolecularWeight: 343.84718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC(C)C(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)O[C@H](C)C(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H22ClNO2/c1-13-10-18(11-14(2)19(13)21)24-15(3)20(23)22-9-8-16-6-4-5-7-17(16)12-22/h4-7,10-11,15H,8-9,12H2,1-3H3/t15-/m1/s1