2-(4-ethanoyl-4-nitroso-5-oxidanylidene-heptanoyl)oxybenzoic acid

Systemtic Name: 2-(4-ethanoyl-4-nitroso-5-oxidanylidene-heptanoyl)oxybenzoic acid Openeye Name: 2-(4-acetyl-4-nitroso-5-oxo-heptanoyl)oxybenzoic acid CAS Name: 2-(4-acetyl-4-nitroso-1,5-dioxoheptoxy)benzoic acid IUPAC Name: 2-(4-acetyl-4-nitroso-5-oxoheptanoyl)oxybenzoic acid Traditional Name: 2-(4-acetyl-5-keto-4-nitroso-heptanoyl)oxybenzoic acid Formula: C16H17NO7 MolecularWeight: 335.30868

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCC(=O)OC1=CC=CC=C1C(=O)O)(C(=O)C)N=O

Isomeric SMILES

CCC(=O)C(CCC(=O)OC1=CC=CC=C1C(=O)O)(C(=O)C)N=O

InChI

InChI=1S/C16H17NO7/c1-3-13(19)16(17-23,10(2)18)9-8-14(20)24-12-7-5-4-6-11(12)15(21)22/h4-7H,3,8-9H2,1-2H3,(H,21,22)