2-chloranyl-6-(3,4-dihydro-1H-isoquinolin-2-yl)benzoate

Systemtic Name: 2-chloranyl-6-(3,4-dihydro-1H-isoquinolin-2-yl)benzoate Openeye Name: 2-chloro-6-(3,4-dihydro-1H-isoquinolin-2-yl)benzoate CAS Name: 2-chloro-6-(3,4-dihydro-1H-isoquinolin-2-yl)benzoate IUPAC Name: 2-chloro-6-(3,4-dihydro-1H-isoquinolin-2-yl)benzoate Traditional Name: 2-chloro-6-(3,4-dihydro-1H-isoquinolin-2-yl)benzoate Formula: C16H13ClNO2- MolecularWeight: 286.73292

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C(=CC=C3)Cl)C(=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C(=CC=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C16H14ClNO2/c17-13-6-3-7-14(15(13)16(19)20)18-9-8-11-4-1-2-5-12(11)10-18/h1-7H,8-10H2,(H,19,20)/p-1