7-methoxy-4-[(3-oxidanylpyridin-1-ium-1-yl)methyl]chromen-2-one

Systemtic Name: 7-methoxy-4-[(3-oxidanylpyridin-1-ium-1-yl)methyl]chromen-2-one Openeye Name: 4-[(3-hydroxypyridin-1-ium-1-yl)methyl]-7-methoxy-chromen-2-one CAS Name: 4-[(3-hydroxy-1-pyridin-1-iumyl)methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[(3-hydroxypyridin-1-ium-1-yl)methyl]-7-methoxychromen-2-one Traditional Name: 4-[(3-hydroxypyridin-1-ium-1-yl)methyl]-7-methoxy-coumarin Formula: C16H14NO4+ MolecularWeight: 284.28666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO4/c1-20-13-4-5-14-11(7-16(19)21-15(14)8-13)9-17-6-2-3-12(18)10-17/h2-8,10H,9H2,1H3/p+1