(2-azanyl-2-oxidanylidene-ethyl) 1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxylate CAS Name: 1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxylate Traditional Name: 1-mesyl-3,4-dihydro-2H-quinoline-6-carboxylic acid (2-amino-2-keto-ethyl) ester Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)OCC(=O)N

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)OCC(=O)N

InChI

InChI=1S/C13H16N2O5S/c1-21(18,19)15-6-2-3-9-7-10(4-5-11(9)15)13(17)20-8-12(14)16/h4-5,7H,2-3,6,8H2,1H3,(H2,14,16)