2-[2-ethyl-6-oxidanyl-4,6-bis(oxidanylidene)hexoxy]carbonylbenzoic acid

Systemtic Name: 2-[2-ethyl-6-oxidanyl-4,6-bis(oxidanylidene)hexoxy]carbonylbenzoic acid Openeye Name: 2-(2-ethyl-6-hydroxy-4,6-dioxo-hexoxy)carbonylbenzoic acid CAS Name: 2-[(2-ethyl-6-hydroxy-4,6-dioxohexoxy)-oxomethyl]benzoic acid IUPAC Name: 2-(2-ethyl-6-hydroxy-4,6-dioxohexoxy)carbonylbenzoic acid Traditional Name: 2-(2-ethyl-6-hydroxy-4,6-diketo-hexoxy)carbonylbenzoic acid Formula: C16H18O7 MolecularWeight: 322.30992

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)CC(=O)O)COC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCC(CC(=O)CC(=O)O)COC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C16H18O7/c1-2-10(7-11(17)8-14(18)19)9-23-16(22)13-6-4-3-5-12(13)15(20)21/h3-6,10H,2,7-9H2,1H3,(H,18,19)(H,20,21)