5-[(E)-4,6-bis(oxidanylidene)oct-1-enyl]-2,3-bis(oxidanyl)benzenecarbonitrile

Systemtic Name: 5-[(E)-4,6-bis(oxidanylidene)oct-1-enyl]-2,3-bis(oxidanyl)benzenecarbonitrile Openeye Name: 5-[(E)-4,6-dioxooct-1-enyl]-2,3-dihydroxy-benzonitrile CAS Name: 5-[(E)-4,6-dioxooct-1-enyl]-2,3-dihydroxybenzonitrile IUPAC Name: 5-[(E)-4,6-dioxooct-1-enyl]-2,3-dihydroxybenzonitrile Traditional Name: 5-[(E)-4,6-diketooct-1-enyl]-2,3-dihydroxy-benzonitrile Formula: C15H15NO4 MolecularWeight: 273.2839

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC(=O)CC=CC1=CC(=C(C(=C1)C#N)O)O

Isomeric SMILES

CCC(=O)CC(=O)C/C=C/C1=CC(=C(C(=C1)C#N)O)O

InChI

InChI=1S/C15H15NO4/c1-2-12(17)8-13(18)5-3-4-10-6-11(9-16)15(20)14(19)7-10/h3-4,6-7,19-20H,2,5,8H2,1H3/b4-3+