4-methyl-9-oxidanylidene-7-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]pyrazolo[5,1-b]quinazoline-2-carboxylic acid

Systemtic Name: 4-methyl-9-oxidanylidene-7-[(4-oxidanyl-4-oxidanylidene-butanoyl)amino]pyrazolo[5,1-b]quinazoline-2-carboxylic acid Openeye Name: 7-[(4-hydroxy-4-oxo-butanoyl)amino]-4-methyl-9-oxo-pyrazolo[5,1-b]quinazoline-2-carboxylic acid CAS Name: 7-[(4-hydroxy-1,4-dioxobutyl)amino]-4-methyl-9-oxo-2-pyrazolo[5,1-b]quinazolinecarboxylic acid IUPAC Name: 7-[(4-hydroxy-4-oxobutanoyl)amino]-4-methyl-9-oxopyrazolo[5,1-b]quinazoline-2-carboxylic acid Traditional Name: 7-[(4-hydroxy-4-keto-butanoyl)amino]-9-keto-4-methyl-pyrazolo[5,1-b]quinazoline-2-carboxylic acid Formula: C16H14N4O6 MolecularWeight: 358.30556

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)CCC(=O)O)C(=O)N3C1=CC(=N3)C(=O)O

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)CCC(=O)O)C(=O)N3C1=CC(=N3)C(=O)O

InChI

InChI=1S/C16H14N4O6/c1-19-11-3-2-8(17-12(21)4-5-14(22)23)6-9(11)15(24)20-13(19)7-10(18-20)16(25)26/h2-3,6-7H,4-5H2,1H3,(H,17,21)(H,22,23)(H,25,26)