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

Systemtic Name: 3,3-dimethyl-8-phenyl-6-[[(2R)-1-phenylpropan-2-yl]amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Openeye Name: 3,3-dimethyl-6-[[(1R)-1-methyl-2-phenyl-ethyl]amino]-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile CAS Name: 3,3-dimethyl-8-phenyl-6-[[(2R)-1-phenylpropan-2-yl]amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile IUPAC Name: 3,3-dimethyl-8-phenyl-6-[[(2R)-1-phenylpropan-2-yl]amino]-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Traditional Name: 3,3-dimethyl-6-[[(1R)-1-methyl-2-phenyl-ethyl]amino]-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-5-carbonitrile Formula: C26H28N3O+ MolecularWeight: 398.52002

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)NC2=[NH+]C(=C3COC(CC3=C2C#N)(C)C)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CC1=CC=CC=C1)NC2=[NH+]C(=C3COC(CC3=C2C#N)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O/c1-18(14-19-10-6-4-7-11-19)28-25-22(16-27)21-15-26(2,3)30-17-23(21)24(29-25)20-12-8-5-9-13-20/h4-13,18H,14-15,17H2,1-3H3,(H,28,29)/p+1/t18-/m1/s1