[2-oxidanylidene-2-(pentylamino)ethyl] 2-chloranylquinoline-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentylamino)ethyl] 2-chloranylquinoline-4-carboxylate Openeye Name: [2-oxo-2-(pentylamino)ethyl] 2-chloroquinoline-4-carboxylate CAS Name: 2-chloro-4-quinolinecarboxylic acid [2-oxo-2-(pentylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentylamino)ethyl] 2-chloroquinoline-4-carboxylate Traditional Name: 2-chlorocinchoninic acid [2-(amylamino)-2-keto-ethyl] ester Formula: C17H19ClN2O3 MolecularWeight: 334.79736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)Cl

Isomeric SMILES

CCCCCNC(=O)COC(=O)C1=CC(=NC2=CC=CC=C21)Cl

InChI

InChI=1S/C17H19ClN2O3/c1-2-3-6-9-19-16(21)11-23-17(22)13-10-15(18)20-14-8-5-4-7-12(13)14/h4-5,7-8,10H,2-3,6,9,11H2,1H3,(H,19,21)