(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl methanesulfonate

Systemtic Name: (6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl methanesulfonate Openeye Name: (6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)methyl methanesulfonate CAS Name: methanesulfonic acid (6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl ester IUPAC Name: (6-chloro-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)methyl methanesulfonate Traditional Name: methanesulfonic acid (6-chloro-1-keto-2-methyl-4-phenyl-3-isoquinolyl)methyl ester Formula: C18H16ClNO4S MolecularWeight: 377.84194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)COS(=O)(=O)C

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)COS(=O)(=O)C

InChI

InChI=1S/C18H16ClNO4S/c1-20-16(11-24-25(2,22)23)17(12-6-4-3-5-7-12)15-10-13(19)8-9-14(15)18(20)21/h3-10H,11H2,1-2H3