2-azanyl-7-methyl-5-oxidanylidene-4-pyridin-1-ium-3-yl-6-(pyridin-1-ium-3-ylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-7-methyl-5-oxidanylidene-4-pyridin-1-ium-3-yl-6-(pyridin-1-ium-3-ylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile Openeye Name: 2-amino-7-methyl-5-oxo-4-pyridin-1-ium-3-yl-6-(pyridin-1-ium-3-ylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile CAS Name: 2-amino-7-methyl-5-oxo-4-(3-pyridin-1-iumyl)-6-(3-pyridin-1-iumylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile IUPAC Name: 2-amino-7-methyl-5-oxo-4-pyridin-1-ium-3-yl-6-(pyridin-1-ium-3-ylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile Traditional Name: 2-amino-5-keto-7-methyl-4-pyridin-1-ium-3-yl-6-(pyridin-1-ium-3-ylmethyl)-4H-pyrano[3,2-c]pyridine-3-carbonitrile Formula: C21H19N5O2+2 MolecularWeight: 373.40786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=C[NH+]=CC=C3)C(=O)N1CC4=C[NH+]=CC=C4

Isomeric SMILES

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=C[NH+]=CC=C3)C(=O)N1CC4=C[NH+]=CC=C4

InChI

InChI=1S/C21H17N5O2/c1-13-8-17-19(21(27)26(13)12-14-4-2-6-24-10-14)18(15-5-3-7-25-11-15)16(9-22)20(23)28-17/h2-8,10-11,18H,12,23H2,1H3/p+2