(E)-4-[2-oxidanyl-1,3-bis(oxidanylidene)inden-2-yl]but-3-enenitrile

Systemtic Name: (E)-4-[2-oxidanyl-1,3-bis(oxidanylidene)inden-2-yl]but-3-enenitrile Openeye Name: (E)-4-(2-hydroxy-1,3-dioxo-indan-2-yl)but-3-enenitrile CAS Name: (E)-4-(2-hydroxy-1,3-dioxo-2-indenyl)-3-butenenitrile IUPAC Name: (E)-4-(2-hydroxy-1,3-dioxoinden-2-yl)but-3-enenitrile Traditional Name: (E)-4-(2-hydroxy-1,3-diketo-indan-2-yl)but-3-enenitrile Formula: C13H9NO3 MolecularWeight: 227.21546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(C2=O)(C=CCC#N)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(C2=O)(/C=C/CC#N)O

InChI

InChI=1S/C13H9NO3/c14-8-4-3-7-13(17)11(15)9-5-1-2-6-10(9)12(13)16/h1-3,5-7,17H,4H2/b7-3+