2-[2,4-bis(oxidanylidene)pentyl]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[2,4-bis(oxidanylidene)pentyl]-5-nitro-benzenecarbonitrile Openeye Name: 2-(2,4-dioxopentyl)-5-nitro-benzonitrile CAS Name: 2-(2,4-dioxopentyl)-5-nitrobenzonitrile IUPAC Name: 2-(2,4-dioxopentyl)-5-nitrobenzonitrile Traditional Name: 2-(2,4-diketopentyl)-5-nitro-benzonitrile Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)CC1=C(C=C(C=C1)[N+](=O)[O-])C#N

Isomeric SMILES

CC(=O)CC(=O)CC1=C(C=C(C=C1)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H10N2O4/c1-8(15)4-12(16)6-9-2-3-11(14(17)18)5-10(9)7-13/h2-3,5H,4,6H2,1H3