3-[bis(oxidanyl)methylidene]-6-butanoyl-7-methyl-1-propyl-quinoline-2,4-dione

Systemtic Name: 3-[bis(oxidanyl)methylidene]-6-butanoyl-7-methyl-1-propyl-quinoline-2,4-dione Openeye Name: 6-butanoyl-3-(dihydroxymethylene)-7-methyl-1-propyl-quinoline-2,4-dione CAS Name: 3-(dihydroxymethylidene)-7-methyl-6-(1-oxobutyl)-1-propylquinoline-2,4-dione IUPAC Name: 6-butanoyl-3-(dihydroxymethylidene)-7-methyl-1-propylquinoline-2,4-dione Traditional Name: 6-butyryl-3-(dihydroxymethylene)-7-methyl-1-propyl-quinoline-2,4-quinone Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C=C2C(=C1)C(=O)C(=C(O)O)C(=O)N2CCC)C

Isomeric SMILES

CCCC(=O)C1=C(C=C2C(=C1)C(=O)C(=C(O)O)C(=O)N2CCC)C

InChI

InChI=1S/C18H21NO5/c1-4-6-14(20)11-9-12-13(8-10(11)3)19(7-5-2)17(22)15(16(12)21)18(23)24/h8-9,23-24H,4-7H2,1-3H3