2-(carboxymethyl)-6,7-dimethoxy-cinnolin-2-ium-4-olate

Systemtic Name: 2-(carboxymethyl)-6,7-dimethoxy-cinnolin-2-ium-4-olate Openeye Name: 2-(carboxymethyl)-6,7-dimethoxy-cinnolin-2-ium-4-olate CAS Name: 2-(carboxymethyl)-6,7-dimethoxy-4-cinnolin-2-iumolate IUPAC Name: 2-(carboxymethyl)-6,7-dimethoxycinnolin-2-ium-4-olate Traditional Name: 2-(carboxymethyl)-6,7-dimethoxy-cinnolin-2-ium-4-olate Formula: C12H12N2O5 MolecularWeight: 264.23408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C[N+](=N2)CC(=O)O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C[N+](=N2)CC(=O)O)[O-])OC

InChI

InChI=1S/C12H12N2O5/c1-18-10-3-7-8(4-11(10)19-2)13-14(5-9(7)15)6-12(16)17/h3-5H,6H2,1-2H3,(H-,13,15,16,17)