[2-[methyl-[2-oxidanylidene-2-(propylamino)ethyl]amino]-2-oxidanylidene-ethyl] 1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxylate

Systemtic Name: [2-[methyl-[2-oxidanylidene-2-(propylamino)ethyl]amino]-2-oxidanylidene-ethyl] 1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxylate Openeye Name: [2-[methyl-[2-oxo-2-(propylamino)ethyl]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-[methyl-[2-oxo-2-(propylamino)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[methyl-[2-oxo-2-(propylamino)ethyl]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-keto-2-[[2-keto-2-(propylamino)ethyl]-methyl-amino]ethyl] ester Formula: C19H27N3O6S MolecularWeight: 425.49918

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)C(=O)COC(=O)C1=CC2=C(C=C1)N(CCC2)S(=O)(=O)C

Isomeric SMILES

CCCNC(=O)CN(C)C(=O)COC(=O)C1=CC2=C(C=C1)N(CCC2)S(=O)(=O)C

InChI

InChI=1S/C19H27N3O6S/c1-4-9-20-17(23)12-21(2)18(24)13-28-19(25)15-7-8-16-14(11-15)6-5-10-22(16)29(3,26)27/h7-8,11H,4-6,9-10,12-13H2,1-3H3,(H,20,23)