3-(2-azaniumylethylcarbamoyl)-4-oxidanylidene-chromen-2-olate

Systemtic Name: 3-(2-azaniumylethylcarbamoyl)-4-oxidanylidene-chromen-2-olate Openeye Name: 3-(2-azaniumylethylcarbamoyl)-4-oxo-chromen-2-olate CAS Name: 3-[(2-ammonioethylamino)-oxomethyl]-4-oxo-1-benzopyran-2-olate IUPAC Name: 3-(2-azaniumylethylcarbamoyl)-4-oxochromen-2-olate Traditional Name: 3-(2-ammonioethylcarbamoyl)-4-keto-chromen-2-olate Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(O2)[O-])C(=O)NCC[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(O2)[O-])C(=O)NCC[NH3+]

InChI

InChI=1S/C12H12N2O4/c13-5-6-14-11(16)9-10(15)7-3-1-2-4-8(7)18-12(9)17/h1-4,17H,5-6,13H2,(H,14,16)