[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-methylquinoline-4-carboxylate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-methylquinoline-4-carboxylate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)C

InChI

InChI=1S/C17H20N2O3/c1-4-11(2)19-16(20)10-22-17(21)14-9-12(3)18-15-8-6-5-7-13(14)15/h5-9,11H,4,10H2,1-3H3,(H,19,20)