7-methoxy-3,4-dihydro-1H-isoquinoline-2-sulfonic acid

Systemtic Name: 7-methoxy-3,4-dihydro-1H-isoquinoline-2-sulfonic acid Openeye Name: 7-methoxy-3,4-dihydro-1H-isoquinoline-2-sulfonic acid CAS Name: 7-methoxy-3,4-dihydro-1H-isoquinoline-2-sulfonic acid IUPAC Name: 7-methoxy-3,4-dihydro-1H-isoquinoline-2-sulfonic acid Traditional Name: 7-methoxy-3,4-dihydro-1H-isoquinoline-2-sulfonic acid Formula: C10H13NO4S MolecularWeight: 243.27952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CCN(C2)S(=O)(=O)O)C=C1

Isomeric SMILES

COC1=CC2=C(CCN(C2)S(=O)(=O)O)C=C1

InChI

InChI=1S/C10H13NO4S/c1-15-10-3-2-8-4-5-11(16(12,13)14)7-9(8)6-10/h2-3,6H,4-5,7H2,1H3,(H,12,13,14)