(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 1-oxidanidylpyridin-1-ium-4-carboxylate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 1-oxidanidylpyridin-1-ium-4-carboxylate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 1-oxidopyridin-1-ium-4-carboxylate CAS Name: 1-oxido-4-pyridin-1-iumcarboxylic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 1-oxidopyridin-1-ium-4-carboxylate Traditional Name: 1-oxidopyridin-1-ium-4-carboxylic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C16H11NO6 MolecularWeight: 313.26164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)OC(=O)C=C2COC(=O)C3=CC=[N+](C=C3)[O-]

Isomeric SMILES

C1=CC2=C(C=C1O)OC(=O)C=C2COC(=O)C3=CC=[N+](C=C3)[O-]

InChI

InChI=1S/C16H11NO6/c18-12-1-2-13-11(7-15(19)23-14(13)8-12)9-22-16(20)10-3-5-17(21)6-4-10/h1-8,18H,9H2