8-hexyl-3-methyl-10-oxidanyl-1,2,3,4-tetrahydrochromeno[3,4-c]pyridin-3-ium-5-one

Systemtic Name: 8-hexyl-3-methyl-10-oxidanyl-1,2,3,4-tetrahydrochromeno[3,4-c]pyridin-3-ium-5-one Openeye Name: 8-hexyl-10-hydroxy-3-methyl-1,2,3,4-tetrahydrochromeno[3,4-c]pyridin-3-ium-5-one CAS Name: 8-hexyl-10-hydroxy-3-methyl-1,2,3,4-tetrahydro[1]benzopyrano[3,4-c]pyridin-3-ium-5-one IUPAC Name: 8-hexyl-10-hydroxy-3-methyl-1,2,3,4-tetrahydrochromeno[3,4-c]pyridin-3-ium-5-one Traditional Name: 8-hexyl-10-hydroxy-3-methyl-1,2,3,4-tetrahydrochromeno[3,4-c]pyridin-3-ium-5-one Formula: C19H26NO3+ MolecularWeight: 316.41464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C3=C(C[NH+](CC3)C)C(=O)O2)C(=C1)O

Isomeric SMILES

CCCCCCC1=CC2=C(C3=C(C[NH+](CC3)C)C(=O)O2)C(=C1)O

InChI

InChI=1S/C19H25NO3/c1-3-4-5-6-7-13-10-16(21)18-14-8-9-20(2)12-15(14)19(22)23-17(18)11-13/h10-11,21H,3-9,12H2,1-2H3/p+1