[1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-propan-2-yl] 2,6-bis(chloranyl)benzoate

Systemtic Name: [1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-propan-2-yl] 2,6-bis(chloranyl)benzoate Openeye Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-methyl-2-oxo-ethyl] 2,6-dichlorobenzoate CAS Name: 2,6-dichlorobenzoic acid [1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxopropan-2-yl] 2,6-dichlorobenzoate Traditional Name: 2,6-dichlorobenzoic acid [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-1-methyl-ethyl] ester Formula: C19H17Cl2NO3 MolecularWeight: 378.24918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C2C1)OC(=O)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CC(C(=O)N1CCC2=CC=CC=C2C1)OC(=O)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C19H17Cl2NO3/c1-12(25-19(24)17-15(20)7-4-8-16(17)21)18(23)22-10-9-13-5-2-3-6-14(13)11-22/h2-8,12H,9-11H2,1H3