4-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]butanoic acid

Systemtic Name: 4-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]butanoic acid Openeye Name: 4-(1,3-dioxo-4H-isoquinolin-2-yl)butanoic acid CAS Name: 4-(1,3-dioxo-4H-isoquinolin-2-yl)butanoic acid IUPAC Name: 4-(1,3-dioxo-4H-isoquinolin-2-yl)butanoic acid Traditional Name: 4-(1,3-diketo-4H-isoquinolin-2-yl)butyric acid Formula: C13H13NO4 MolecularWeight: 247.24662

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CCCC(=O)O

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CCCC(=O)O

InChI

InChI=1S/C13H13NO4/c15-11-8-9-4-1-2-5-10(9)13(18)14(11)7-3-6-12(16)17/h1-2,4-5H,3,6-8H2,(H,16,17)