3,3,8-trimethyl-6-piperazin-4-ium-1-yl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile

Systemtic Name: 3,3,8-trimethyl-6-piperazin-4-ium-1-yl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 3,3,8-trimethyl-6-piperazin-4-ium-1-yl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 3,3,8-trimethyl-6-(1-piperazin-4-iumyl)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 3,3,8-trimethyl-6-piperazin-4-ium-1-yl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 3,3,8-trimethyl-6-piperazin-4-ium-1-yl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C16H24N4O+2 MolecularWeight: 288.38796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2COC(CC2=C(C(=[NH+]1)N3CC[NH2+]CC3)C#N)(C)C

Isomeric SMILES

CC1=C2COC(CC2=C(C(=[NH+]1)N3CC[NH2+]CC3)C#N)(C)C

InChI

InChI=1S/C16H22N4O/c1-11-14-10-21-16(2,3)8-12(14)13(9-17)15(19-11)20-6-4-18-5-7-20/h18H,4-8,10H2,1-3H3/p+2