10-(2-methylpropanoyloxy)-4-oxidanylidene-6,7-dihydropyrimido[2,1-a]isoquinoline-3-carboxylic acid

Systemtic Name: 10-(2-methylpropanoyloxy)-4-oxidanylidene-6,7-dihydropyrimido[2,1-a]isoquinoline-3-carboxylic acid Openeye Name: 10-(2-methylpropanoyloxy)-4-oxo-6,7-dihydropyrimido[2,1-a]isoquinoline-3-carboxylic acid CAS Name: 10-(2-methyl-1-oxopropoxy)-4-oxo-6,7-dihydropyrimido[2,1-a]isoquinoline-3-carboxylic acid IUPAC Name: 10-(2-methylpropanoyloxy)-4-oxo-6,7-dihydropyrimido[2,1-a]isoquinoline-3-carboxylic acid Traditional Name: 10-isobutyryloxy-4-keto-6,7-dihydropyrimid[2,1-a]isoquinoline-3-carboxylic acid Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC1=CC2=C(CCN3C2=NC=C(C3=O)C(=O)O)C=C1

Isomeric SMILES

CC(C)C(=O)OC1=CC2=C(CCN3C2=NC=C(C3=O)C(=O)O)C=C1

InChI

InChI=1S/C17H16N2O5/c1-9(2)17(23)24-11-4-3-10-5-6-19-14(12(10)7-11)18-8-13(15(19)20)16(21)22/h3-4,7-9H,5-6H2,1-2H3,(H,21,22)