(8aS)-8-ethyl-5-oxidanyl-6,7-diphenyl-8,8a-dihydropyrano[3,2-c]pyridin-6-ium-2,4-dione

Systemtic Name: (8aS)-8-ethyl-5-oxidanyl-6,7-diphenyl-8,8a-dihydropyrano[3,2-c]pyridin-6-ium-2,4-dione Openeye Name: (8aS)-8-ethyl-5-hydroxy-6,7-diphenyl-8,8a-dihydropyrano[3,2-c]pyridin-6-ium-2,4-dione CAS Name: (8aS)-8-ethyl-5-hydroxy-6,7-diphenyl-8,8a-dihydropyrano[3,2-c]pyridin-6-ium-2,4-dione IUPAC Name: (8aS)-8-ethyl-5-hydroxy-6,7-diphenyl-8,8a-dihydropyrano[3,2-c]pyridin-6-ium-2,4-dione Traditional Name: (8aS)-8-ethyl-5-hydroxy-6,7-diphenyl-8,8a-dihydropyrano[3,2-c]pyridin-6-ium-2,4-quinone Formula: C22H20NO4+ MolecularWeight: 362.3985

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2C(=C([N+](=C1C3=CC=CC=C3)C4=CC=CC=C4)O)C(=O)CC(=O)O2

Isomeric SMILES

CCC1[C@H]2C(=C([N+](=C1C3=CC=CC=C3)C4=CC=CC=C4)O)C(=O)CC(=O)O2

InChI

InChI=1S/C22H19NO4/c1-2-16-20(14-9-5-3-6-10-14)23(15-11-7-4-8-12-15)22(26)19-17(24)13-18(25)27-21(16)19/h3-12,16,21H,2,13H2,1H3/p+1/t16?,21-/m0/s1