1-(2,4-dimethoxyphenyl)-3-(1-oxidanidylpyridin-1-ium-4-yl)butan-1-one

Systemtic Name: 1-(2,4-dimethoxyphenyl)-3-(1-oxidanidylpyridin-1-ium-4-yl)butan-1-one Openeye Name: 1-(2,4-dimethoxyphenyl)-3-(1-oxidopyridin-1-ium-4-yl)butan-1-one CAS Name: 1-(2,4-dimethoxyphenyl)-3-(1-oxido-4-pyridin-1-iumyl)-1-butanone IUPAC Name: 1-(2,4-dimethoxyphenyl)-3-(1-oxidopyridin-1-ium-4-yl)butan-1-one Traditional Name: 1-(2,4-dimethoxyphenyl)-3-(1-oxidopyridin-1-ium-4-yl)butan-1-one Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=C(C=C(C=C1)OC)OC)C2=CC=[N+](C=C2)[O-]

Isomeric SMILES

CC(CC(=O)C1=C(C=C(C=C1)OC)OC)C2=CC=[N+](C=C2)[O-]

InChI

InChI=1S/C17H19NO4/c1-12(13-6-8-18(20)9-7-13)10-16(19)15-5-4-14(21-2)11-17(15)22-3/h4-9,11-12H,10H2,1-3H3