6-[(E)-1-methoxy-1-oxidanyl-prop-1-en-2-yl]sulfanyl-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile

Systemtic Name: 6-[(E)-1-methoxy-1-oxidanyl-prop-1-en-2-yl]sulfanyl-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 6-[(E)-2-hydroxy-2-methoxy-1-methyl-vinyl]sulfanyl-3,3-dimethyl-8-morpholino-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 6-[[(E)-1-hydroxy-1-methoxyprop-1-en-2-yl]thio]-3,3-dimethyl-8-(4-morpholinyl)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 6-[(E)-1-hydroxy-1-methoxyprop-1-en-2-yl]sulfanyl-3,3-dimethyl-8-morpholin-4-yl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 6-[[(E)-2-hydroxy-2-methoxy-1-methyl-vinyl]thio]-3,3-dimethyl-8-morpholino-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C19H26N3O4S+ MolecularWeight: 392.49244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(O)OC)SC1=[NH+]C(=C2COC(CC2=C1C#N)(C)C)N3CCOCC3

Isomeric SMILES

C/C(=C(/O)\OC)/SC1=[NH+]C(=C2COC(CC2=C1C#N)(C)C)N3CCOCC3

InChI

InChI=1S/C19H25N3O4S/c1-12(18(23)24-4)27-17-14(10-20)13-9-19(2,3)26-11-15(13)16(21-17)22-5-7-25-8-6-22/h23H,5-9,11H2,1-4H3/p+1/b18-12+