8-azanyl-4-oxidanylidene-pyrimido[2,1-a]isoquinoline-3-carboxylic acid

Systemtic Name: 8-azanyl-4-oxidanylidene-pyrimido[2,1-a]isoquinoline-3-carboxylic acid Openeye Name: 8-amino-4-oxo-pyrimido[2,1-a]isoquinoline-3-carboxylic acid CAS Name: 8-amino-4-oxo-3-pyrimido[2,1-a]isoquinolinecarboxylic acid IUPAC Name: 8-amino-4-oxopyrimido[2,1-a]isoquinoline-3-carboxylic acid Traditional Name: 8-amino-4-keto-pyrimid[2,1-a]isoquinoline-3-carboxylic acid Formula: C13H9N3O3 MolecularWeight: 255.22886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN3C2=NC=C(C3=O)C(=O)O)C(=C1)N

Isomeric SMILES

C1=CC2=C(C=CN3C2=NC=C(C3=O)C(=O)O)C(=C1)N

InChI

InChI=1S/C13H9N3O3/c14-10-3-1-2-8-7(10)4-5-16-11(8)15-6-9(12(16)17)13(18)19/h1-6H,14H2,(H,18,19)