2-[(5R)-2,4-bis(azanyl)-3-cyano-5H-chromeno[2,3-b]pyridin-1-ium-5-yl]propanedinitrile

Systemtic Name: 2-[(5R)-2,4-bis(azanyl)-3-cyano-5H-chromeno[2,3-b]pyridin-1-ium-5-yl]propanedinitrile Openeye Name: 2-[(5R)-2,4-diamino-3-cyano-5H-chromeno[2,3-b]pyridin-1-ium-5-yl]propanedinitrile CAS Name: 2-[(5R)-2,4-diamino-3-cyano-5H-[1]benzopyrano[2,3-b]pyridin-1-ium-5-yl]propanedinitrile IUPAC Name: 2-[(5R)-2,4-diamino-3-cyano-5H-chromeno[2,3-b]pyridin-1-ium-5-yl]propanedinitrile Traditional Name: 2-[(5R)-2,4-diamino-3-cyano-5H-chromeno[2,3-b]pyridin-1-ium-5-yl]malononitrile Formula: C16H11N6O+ MolecularWeight: 303.29814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=C(O2)[NH+]=C(C(=C3N)C#N)N)C(C#N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)[C@H](C3=C(O2)[NH+]=C(C(=C3N)C#N)N)C(C#N)C#N

InChI

InChI=1S/C16H10N6O/c17-5-8(6-18)12-9-3-1-2-4-11(9)23-16-13(12)14(20)10(7-19)15(21)22-16/h1-4,8,12H,(H4,20,21,22)/p+1/t12-/m1/s1