8-ethyl-3,3-dimethyl-6-[[(2R)-1-phenylpropan-2-yl]amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile

Systemtic Name: 8-ethyl-3,3-dimethyl-6-[[(2R)-1-phenylpropan-2-yl]amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 8-ethyl-3,3-dimethyl-6-[[(1R)-1-methyl-2-phenyl-ethyl]amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 8-ethyl-3,3-dimethyl-6-[[(2R)-1-phenylpropan-2-yl]amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 8-ethyl-3,3-dimethyl-6-[[(2R)-1-phenylpropan-2-yl]amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 8-ethyl-3,3-dimethyl-6-[[(1R)-1-methyl-2-phenyl-ethyl]amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C22H28N3O+ MolecularWeight: 350.47722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2COC(CC2=C(C(=[NH+]1)NC(C)CC3=CC=CC=C3)C#N)(C)C

Isomeric SMILES

CCC1=C2COC(CC2=C(C(=[NH+]1)N[C@H](C)CC3=CC=CC=C3)C#N)(C)C

InChI

InChI=1S/C22H27N3O/c1-5-20-19-14-26-22(3,4)12-17(19)18(13-23)21(25-20)24-15(2)11-16-9-7-6-8-10-16/h6-10,15H,5,11-12,14H2,1-4H3,(H,24,25)/p+1/t15-/m1/s1