ethyl 2-azanyl-4-(2-ethanoyl-3-oxidanylidene-butanoyl)quinoline-3-carboxylate

Systemtic Name: ethyl 2-azanyl-4-(2-ethanoyl-3-oxidanylidene-butanoyl)quinoline-3-carboxylate Openeye Name: ethyl 4-(2-acetyl-3-oxo-butanoyl)-2-amino-quinoline-3-carboxylate CAS Name: 4-(2-acetyl-1,3-dioxobutyl)-2-amino-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-acetyl-3-oxobutanoyl)-2-aminoquinoline-3-carboxylate Traditional Name: 4-(2-acetyl-3-keto-butanoyl)-2-amino-quinoline-3-carboxylic acid ethyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1N)C(=O)C(C(=O)C)C(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1N)C(=O)C(C(=O)C)C(=O)C

InChI

InChI=1S/C18H18N2O5/c1-4-25-18(24)15-14(16(23)13(9(2)21)10(3)22)11-7-5-6-8-12(11)20-17(15)19/h5-8,13H,4H2,1-3H3,(H2,19,20)