2-ethanoyl-5-methoxy-3,6-bis(oxidanyl)benzenecarbonitrile

Systemtic Name: 2-ethanoyl-5-methoxy-3,6-bis(oxidanyl)benzenecarbonitrile Openeye Name: 2-acetyl-3,6-dihydroxy-5-methoxy-benzonitrile CAS Name: 2-acetyl-3,6-dihydroxy-5-methoxybenzonitrile IUPAC Name: 2-acetyl-3,6-dihydroxy-5-methoxybenzonitrile Traditional Name: 2-acetyl-3,6-dihydroxy-5-methoxy-benzonitrile Formula: C10H9NO4 MolecularWeight: 207.18276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=C(C=C1O)OC)O)C#N

Isomeric SMILES

CC(=O)C1=C(C(=C(C=C1O)OC)O)C#N

InChI

InChI=1S/C10H9NO4/c1-5(12)9-6(4-11)10(14)8(15-2)3-7(9)13/h3,13-14H,1-2H3