2-[[5-oxidanyl-2,5-bis(oxidanylidene)pentyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[5-oxidanyl-2,5-bis(oxidanylidene)pentyl]carbamoyl]benzoic acid Openeye Name: 2-[(5-hydroxy-2,5-dioxo-pentyl)carbamoyl]benzoic acid CAS Name: 2-[[(5-hydroxy-2,5-dioxopentyl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(5-hydroxy-2,5-dioxopentyl)carbamoyl]benzoic acid Traditional Name: 2-[(5-hydroxy-2,5-diketo-pentyl)carbamoyl]benzoic acid Formula: C13H13NO6 MolecularWeight: 279.24542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCC(=O)CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCC(=O)CCC(=O)O)C(=O)O

InChI

InChI=1S/C13H13NO6/c15-8(5-6-11(16)17)7-14-12(18)9-3-1-2-4-10(9)13(19)20/h1-4H,5-7H2,(H,14,18)(H,16,17)(H,19,20)