2-[(5-cyano-3,3-dimethyl-6-phenylazanyl-1,4-dihydropyrano[3,4-c]pyridin-8-yl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(5-cyano-3,3-dimethyl-6-phenylazanyl-1,4-dihydropyrano[3,4-c]pyridin-8-yl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(6-anilino-5-cyano-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-8-yl)amino]ethyl-dimethyl-ammonium CAS Name: 2-[(6-anilino-5-cyano-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-8-yl)amino]ethyl-dimethylammonium IUPAC Name: 2-[(6-anilino-5-cyano-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-8-yl)amino]ethyl-dimethylazanium Traditional Name: 2-[(6-anilino-5-cyano-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-8-yl)amino]ethyl-dimethyl-ammonium Formula: C21H28N5O+ MolecularWeight: 366.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=NC(=C2CO1)NCC[NH+](C)C)NC3=CC=CC=C3)C#N)C

Isomeric SMILES

CC1(CC2=C(C(=NC(=C2CO1)NCC[NH+](C)C)NC3=CC=CC=C3)C#N)C

InChI

InChI=1S/C21H27N5O/c1-21(2)12-16-17(13-22)20(24-15-8-6-5-7-9-15)25-19(18(16)14-27-21)23-10-11-26(3)4/h5-9H,10-12,14H2,1-4H3,(H2,23,24,25)/p+1