3-[3-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl]indol-1-yl]propanenitrile

Systemtic Name: 3-[3-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl]indol-1-yl]propanenitrile Openeye Name: 3-[3-[2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetyl]indol-1-yl]propanenitrile CAS Name: 3-[3-[2-(4-nitro-1,3-dioxo-2-isoindolyl)-1-oxoethyl]-1-indolyl]propanenitrile IUPAC Name: 3-[3-[2-(4-nitro-1,3-dioxoisoindol-2-yl)acetyl]indol-1-yl]propanenitrile Traditional Name: 3-[3-[2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetyl]indol-1-yl]propionitrile Formula: C21H14N4O5 MolecularWeight: 402.35966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCC#N)C(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCC#N)C(=O)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14N4O5/c22-9-4-10-23-11-15(13-5-1-2-7-16(13)23)18(26)12-24-20(27)14-6-3-8-17(25(29)30)19(14)21(24)28/h1-3,5-8,11H,4,10,12H2