2-[(5-chloranyl-2-methoxy-phenyl)methylsulfonyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-[(5-chloranyl-2-methoxy-phenyl)methylsulfonyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 2-[(5-chloro-2-methoxy-phenyl)methylsulfonyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 2-[(5-chloro-2-methoxyphenyl)methylsulfonyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-[(5-chloro-2-methoxyphenyl)methylsulfonyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 2-(5-chloro-2-methoxy-benzyl)sulfonyl-1-(3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C19H20ClNO4S MolecularWeight: 393.8844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)CS(=O)(=O)CC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)CS(=O)(=O)CC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C19H20ClNO4S/c1-25-18-7-6-17(20)10-16(18)12-26(23,24)13-19(22)21-9-8-14-4-2-3-5-15(14)11-21/h2-7,10H,8-9,11-13H2,1H3