(2,4-dimethoxyphenyl)-(5-oxidanyl-1-oxidanylidene-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ium-2-yl)methanone

Systemtic Name: (2,4-dimethoxyphenyl)-(5-oxidanyl-1-oxidanylidene-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ium-2-yl)methanone Openeye Name: (2,4-dimethoxyphenyl)-(5-hydroxy-1-oxo-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ium-2-yl)methanone CAS Name: (2,4-dimethoxyphenyl)-(5-hydroxy-1-oxo-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ium-2-yl)methanone IUPAC Name: (2,4-dimethoxyphenyl)-(5-hydroxy-1-oxo-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ium-2-yl)methanone Traditional Name: (2,4-dimethoxyphenyl)-(5-hydroxy-1-keto-2,3,4,4a,5,6,7,7a-octahydro-1-pyrindin-1-ium-2-yl)methanone Formula: C17H22NO5+ MolecularWeight: 320.36028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C2CCC3C([N+]2=O)CCC3O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)C2CCC3C([N+]2=O)CCC3O)OC

InChI

InChI=1S/C17H22NO5/c1-22-10-3-4-12(16(9-10)23-2)17(20)14-6-5-11-13(18(14)21)7-8-15(11)19/h3-4,9,11,13-15,19H,5-8H2,1-2H3/q+1