3,3-dimethyl-6-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]-8-propan-2-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile

Systemtic Name: 3,3-dimethyl-6-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]-8-propan-2-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Openeye Name: 8-isopropyl-3,3-dimethyl-6-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-1-yl]-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile CAS Name: 3,3-dimethyl-6-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazin-4-iumyl]-8-propan-2-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile IUPAC Name: 3,3-dimethyl-6-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-1-yl]-8-propan-2-yl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Traditional Name: 8-isopropyl-6-[4-(2-keto-2-piperidino-ethyl)piperazin-4-ium-1-yl]-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile Formula: C25H38N5O2+ MolecularWeight: 440.60152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2COC(CC2=C(C(=N1)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C#N)(C)C

Isomeric SMILES

CC(C)C1=C2COC(CC2=C(C(=N1)N3CC[NH+](CC3)CC(=O)N4CCCCC4)C#N)(C)C

InChI

InChI=1S/C25H37N5O2/c1-18(2)23-21-17-32-25(3,4)14-19(21)20(15-26)24(27-23)30-12-10-28(11-13-30)16-22(31)29-8-6-5-7-9-29/h18H,5-14,16-17H2,1-4H3/p+1