2-[(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)amino]ethyl-diethyl-azanium

Systemtic Name: 2-[(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)amino]ethyl-diethyl-azanium Openeye Name: 2-[(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)amino]ethyl-diethyl-ammonium CAS Name: 2-[(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)amino]ethyl-diethylammonium IUPAC Name: 2-[(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)amino]ethyl-diethylazanium Traditional Name: 2-[(5-cyano-3,3-dimethyl-8-phenyl-1,4-dihydropyrano[3,4-c]pyridin-7-ium-6-yl)amino]ethyl-diethyl-ammonium Formula: C23H32N4O+2 MolecularWeight: 380.52638

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC1=[NH+]C(=C2COC(CC2=C1C#N)(C)C)C3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCNC1=[NH+]C(=C2COC(CC2=C1C#N)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C23H30N4O/c1-5-27(6-2)13-12-25-22-19(15-24)18-14-23(3,4)28-16-20(18)21(26-22)17-10-8-7-9-11-17/h7-11H,5-6,12-14,16H2,1-4H3,(H,25,26)/p+2