dimethyl sulfate; 7-methoxy-1-methyl-2H-isoquinolin-6-one

Systemtic Name: dimethyl sulfate; 7-methoxy-1-methyl-2H-isoquinolin-6-one Openeye Name: dimethyl sulfate; 7-methoxy-1-methyl-2H-isoquinolin-6-one CAS Name: 7-methoxy-1-methyl-2H-isoquinolin-6-one; sulfuric acid dimethyl ester IUPAC Name: dimethyl sulfate; 7-methoxy-1-methyl-2H-isoquinolin-6-one Traditional Name: 7-methoxy-1-methyl-2H-isoquinolin-6-one; sulfuric acid dimethyl ester Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)C=C2C=CN1)OC.COS(=O)(=O)OC

Isomeric SMILES

CC1=C2C=C(C(=O)C=C2C=CN1)OC.COS(=O)(=O)OC

InChI

InChI=1S/C11H11NO2.C2H6O4S/c1-7-9-6-11(14-2)10(13)5-8(9)3-4-12-7;1-5-7(3,4)6-2/h3-6,12H,1-2H3;1-2H3