[2-(butylamino)-2-oxidanylidene-ethyl] 2,6-dimethylquinoline-4-carboxylate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 2,6-dimethylquinoline-4-carboxylate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 2,6-dimethylquinoline-4-carboxylate CAS Name: 2,6-dimethyl-4-quinolinecarboxylic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 2,6-dimethylquinoline-4-carboxylate Traditional Name: 2,6-dimethylcinchoninic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=CC(=NC2=C1C=C(C=C2)C)C

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=CC(=NC2=C1C=C(C=C2)C)C

InChI

InChI=1S/C18H22N2O3/c1-4-5-8-19-17(21)11-23-18(22)15-10-13(3)20-16-7-6-12(2)9-14(15)16/h6-7,9-10H,4-5,8,11H2,1-3H3,(H,19,21)