3,3-dimethyl-6-piperazin-4-ium-1-yl-8-propyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile

Systemtic Name: 3,3-dimethyl-6-piperazin-4-ium-1-yl-8-propyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Openeye Name: 3,3-dimethyl-6-piperazin-4-ium-1-yl-8-propyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile CAS Name: 3,3-dimethyl-6-(1-piperazin-4-iumyl)-8-propyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile IUPAC Name: 3,3-dimethyl-6-piperazin-4-ium-1-yl-8-propyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Traditional Name: 3,3-dimethyl-6-piperazin-4-ium-1-yl-8-propyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Formula: C18H27N4O+ MolecularWeight: 315.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2COC(CC2=C(C(=N1)N3CC[NH2+]CC3)C#N)(C)C

Isomeric SMILES

CCCC1=C2COC(CC2=C(C(=N1)N3CC[NH2+]CC3)C#N)(C)C

InChI

InChI=1S/C18H26N4O/c1-4-5-16-15-12-23-18(2,3)10-13(15)14(11-19)17(21-16)22-8-6-20-7-9-22/h20H,4-10,12H2,1-3H3/p+1