(3-ethyl-9-methyl-3,5-dihydro-2H-[1,4]dioxepino[5,6-c]pyridin-8-ium-6-yl)methanol

Systemtic Name: (3-ethyl-9-methyl-3,5-dihydro-2H-[1,4]dioxepino[5,6-c]pyridin-8-ium-6-yl)methanol Openeye Name: (3-ethyl-9-methyl-3,5-dihydro-2H-[1,4]dioxepino[5,6-c]pyridin-8-ium-6-yl)methanol CAS Name: (3-ethyl-9-methyl-3,5-dihydro-2H-[1,4]dioxepino[5,6-c]pyridin-8-ium-6-yl)methanol IUPAC Name: (3-ethyl-9-methyl-3,5-dihydro-2H-[1,4]dioxepino[5,6-c]pyridin-8-ium-6-yl)methanol Traditional Name: (3-ethyl-9-methyl-3,5-dihydro-2H-[1,4]dioxepino[5,6-c]pyridin-8-ium-6-yl)methanol Formula: C12H18NO3+ MolecularWeight: 224.27622

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Descriptors Computed from Structure

Canonical SMILES:

CCC1COC2=C(CO1)C(=C[NH+]=C2C)CO

Isomeric SMILES

CCC1COC2=C(CO1)C(=C[NH+]=C2C)CO

InChI

InChI=1S/C12H17NO3/c1-3-10-6-16-12-8(2)13-4-9(5-14)11(12)7-15-10/h4,10,14H,3,5-7H2,1-2H3/p+1