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

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 1-oxidanidylpyridin-1-ium-2-carboxylate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 1-oxidopyridin-1-ium-2-carboxylate CAS Name: 1-oxido-2-pyridin-1-iumcarboxylic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 1-oxidopyridin-1-ium-2-carboxylate Traditional Name: 1-oxidopyridin-1-ium-2-carboxylic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C17H13NO6 MolecularWeight: 327.28822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=CC=[N+]3[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C17H13NO6/c1-22-12-5-6-13-11(8-16(19)24-15(13)9-12)10-23-17(20)14-4-2-3-7-18(14)21/h2-9H,10H2,1H3