methyl 7-methylisoquinoline-6-sulfonate

Systemtic Name: methyl 7-methylisoquinoline-6-sulfonate Openeye Name: methyl 7-methylisoquinoline-6-sulfonate CAS Name: 7-methyl-6-isoquinolinesulfonic acid methyl ester IUPAC Name: methyl 7-methylisoquinoline-6-sulfonate Traditional Name: 7-methylisoquinoline-6-sulfonic acid methyl ester Formula: C11H11NO3S MolecularWeight: 237.27494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CN=CC2=C1)S(=O)(=O)OC

Isomeric SMILES

CC1=C(C=C2C=CN=CC2=C1)S(=O)(=O)OC

InChI

InChI=1S/C11H11NO3S/c1-8-5-10-7-12-4-3-9(10)6-11(8)16(13,14)15-2/h3-7H,1-2H3