6-butanoyl-7,8-dimethyl-4-oxidanylidene-1H-quinoline-2-carboxylic acid

Systemtic Name: 6-butanoyl-7,8-dimethyl-4-oxidanylidene-1H-quinoline-2-carboxylic acid Openeye Name: 6-butanoyl-7,8-dimethyl-4-oxo-1H-quinoline-2-carboxylic acid CAS Name: 7,8-dimethyl-4-oxo-6-(1-oxobutyl)-1H-quinoline-2-carboxylic acid IUPAC Name: 6-butanoyl-7,8-dimethyl-4-oxo-1H-quinoline-2-carboxylic acid Traditional Name: 6-butyryl-4-keto-7,8-dimethyl-1H-quinoline-2-carboxylic acid Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C(=C2C(=C1)C(=O)C=C(N2)C(=O)O)C)C

Isomeric SMILES

CCCC(=O)C1=C(C(=C2C(=C1)C(=O)C=C(N2)C(=O)O)C)C

InChI

InChI=1S/C16H17NO4/c1-4-5-13(18)10-6-11-14(19)7-12(16(20)21)17-15(11)9(3)8(10)2/h6-7H,4-5H2,1-3H3,(H,17,19)(H,20,21)