3,3,8-trimethyl-6-(4-pyrrolidin-1-ylcarbonylpiperazin-1-yl)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile

Systemtic Name: 3,3,8-trimethyl-6-(4-pyrrolidin-1-ylcarbonylpiperazin-1-yl)-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 3,3,8-trimethyl-6-[4-(pyrrolidine-1-carbonyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 3,3,8-trimethyl-6-[4-[oxo(1-pyrrolidinyl)methyl]-1-piperazinyl]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 3,3,8-trimethyl-6-[4-(pyrrolidine-1-carbonyl)piperazin-1-yl]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 3,3,8-trimethyl-6-[4-(pyrrolidine-1-carbonyl)piperazino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C21H30N5O2+ MolecularWeight: 384.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2COC(CC2=C(C(=[NH+]1)N3CCN(CC3)C(=O)N4CCCC4)C#N)(C)C

Isomeric SMILES

CC1=C2COC(CC2=C(C(=[NH+]1)N3CCN(CC3)C(=O)N4CCCC4)C#N)(C)C

InChI

InChI=1S/C21H29N5O2/c1-15-18-14-28-21(2,3)12-16(18)17(13-22)19(23-15)24-8-10-26(11-9-24)20(27)25-6-4-5-7-25/h4-12,14H2,1-3H3/p+1