(3R)-N-(5-chloranyl-2-methoxy-phenyl)-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-N-(5-chloranyl-2-methoxy-phenyl)-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-N-(5-chloro-2-methoxy-phenyl)-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-N-(5-chloro-2-methoxyphenyl)-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-N-(5-chloro-2-methoxyphenyl)-2-methylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-N-(5-chloro-2-methoxy-phenyl)-2-mesyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C18H19ClN2O4S MolecularWeight: 394.87246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)[C@H]2CC3=CC=CC=C3CN2S(=O)(=O)C

InChI

InChI=1S/C18H19ClN2O4S/c1-25-17-8-7-14(19)10-15(17)20-18(22)16-9-12-5-3-4-6-13(12)11-21(16)26(2,23)24/h3-8,10,16H,9,11H2,1-2H3,(H,20,22)/t16-/m1/s1