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

Systemtic Name: (2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl methanesulfonate Openeye Name: (2-methyl-1-oxo-4-phenyl-3-isoquinolyl)methyl methanesulfonate CAS Name: methanesulfonic acid (2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl ester IUPAC Name: (2-methyl-1-oxo-4-phenylisoquinolin-3-yl)methyl methanesulfonate Traditional Name: methanesulfonic acid (1-keto-2-methyl-4-phenyl-3-isoquinolyl)methyl ester Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)COS(=O)(=O)C

Isomeric SMILES

CN1C(=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)COS(=O)(=O)C

InChI

InChI=1S/C18H17NO4S/c1-19-16(12-23-24(2,21)22)17(13-8-4-3-5-9-13)14-10-6-7-11-15(14)18(19)20/h3-11H,12H2,1-2H3