(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: (2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: [2-chloro-5-(1-piperidylsulfonyl)phenyl]-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [2-chloro-5-(1-piperidinylsulfonyl)phenyl]-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (2-chloro-5-piperidin-1-ylsulfonylphenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (2-chloro-5-piperidinosulfonyl-phenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C23H27ClN2O5S MolecularWeight: 478.98888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Cl)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Cl)OC

InChI

InChI=1S/C23H27ClN2O5S/c1-30-21-12-16-8-11-25(15-17(16)13-22(21)31-2)23(27)19-14-18(6-7-20(19)24)32(28,29)26-9-4-3-5-10-26/h6-7,12-14H,3-5,8-11,15H2,1-2H3