2-(2,3-dihydroisoindol-2-ium-1-ylidene)propanedinitrile

Systemtic Name: 2-(2,3-dihydroisoindol-2-ium-1-ylidene)propanedinitrile Openeye Name: 2-isoindolin-2-ium-1-ylidenepropanedinitrile CAS Name: 2-(2,3-dihydroisoindol-2-ium-1-ylidene)propanedinitrile IUPAC Name: 2-(2,3-dihydroisoindol-2-ium-1-ylidene)propanedinitrile Traditional Name: 2-isoindolin-2-ium-1-ylidenemalononitrile Formula: C11H8N3+ MolecularWeight: 182.20132

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=C(C#N)C#N)[NH2+]1

Isomeric SMILES

C1C2=CC=CC=C2C(=C(C#N)C#N)[NH2+]1

InChI

InChI=1S/C11H7N3/c12-5-9(6-13)11-10-4-2-1-3-8(10)7-14-11/h1-4,14H,7H2/p+1