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

Systemtic Name: 2-(4-oxidanylidene-6-phenylmethoxy-1H-cinnolin-3-yl)propanoic acid Openeye Name: 2-(6-benzyloxy-4-oxo-1H-cinnolin-3-yl)propanoic acid CAS Name: 2-(4-oxo-6-phenylmethoxy-1H-cinnolin-3-yl)propanoic acid IUPAC Name: 2-(4-oxo-6-phenylmethoxy-1H-cinnolin-3-yl)propanoic acid Traditional Name: 2-(6-benzoxy-4-keto-1H-cinnolin-3-yl)propionic acid Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NNC2=C(C1=O)C=C(C=C2)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C1=NNC2=C(C1=O)C=C(C=C2)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H16N2O4/c1-11(18(22)23)16-17(21)14-9-13(7-8-15(14)19-20-16)24-10-12-5-3-2-4-6-12/h2-9,11H,10H2,1H3,(H,19,21)(H,22,23)