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

Systemtic Name: (2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (2-chloro-5-morpholinosulfonyl-phenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [2-chloro-5-(4-morpholinylsulfonyl)phenyl]-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (2-chloro-5-morpholin-4-ylsulfonylphenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (2-chloro-5-morpholinosulfonyl-phenyl)-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C22H25ClN2O6S MolecularWeight: 480.9617

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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)N4CCOCC4)Cl)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl)OC

InChI

InChI=1S/C22H25ClN2O6S/c1-29-20-11-15-5-6-24(14-16(15)12-21(20)30-2)22(26)18-13-17(3-4-19(18)23)32(27,28)25-7-9-31-10-8-25/h3-4,11-13H,5-10,14H2,1-2H3