2-(4-oxidanylidene-6-propyl-1H-cinnolin-3-yl)propanoic acid

Systemtic Name: 2-(4-oxidanylidene-6-propyl-1H-cinnolin-3-yl)propanoic acid Openeye Name: 2-(4-oxo-6-propyl-1H-cinnolin-3-yl)propanoic acid CAS Name: 2-(4-oxo-6-propyl-1H-cinnolin-3-yl)propanoic acid IUPAC Name: 2-(4-oxo-6-propyl-1H-cinnolin-3-yl)propanoic acid Traditional Name: 2-(4-keto-6-propyl-1H-cinnolin-3-yl)propionic acid Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)NN=C(C2=O)C(C)C(=O)O

Isomeric SMILES

CCCC1=CC2=C(C=C1)NN=C(C2=O)C(C)C(=O)O

InChI

InChI=1S/C14H16N2O3/c1-3-4-9-5-6-11-10(7-9)13(17)12(16-15-11)8(2)14(18)19/h5-8H,3-4H2,1-2H3,(H,15,17)(H,18,19)