methyl 7-(methylsulfonylmethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: methyl 7-(methylsulfonylmethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: methyl 7-(methylsulfonylmethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 7-(methylsulfonylmethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid methyl ester IUPAC Name: methyl 7-(methylsulfonylmethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 7-(mesylmethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid methyl ester Formula: C13H17NO4S MolecularWeight: 283.34338

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC2=C(C1)C=C(C=C2)CS(=O)(=O)C

Isomeric SMILES

COC(=O)N1CCC2=C(C1)C=C(C=C2)CS(=O)(=O)C

InChI

InChI=1S/C13H17NO4S/c1-18-13(15)14-6-5-11-4-3-10(7-12(11)8-14)9-19(2,16)17/h3-4,7H,5-6,8-9H2,1-2H3