3,5-bis[(5-oxidanyl-5-oxidanylidene-pentanoyl)amino]benzoic acid

Systemtic Name: 3,5-bis[(5-oxidanyl-5-oxidanylidene-pentanoyl)amino]benzoic acid Openeye Name: 3,5-bis[(5-hydroxy-5-oxo-pentanoyl)amino]benzoic acid CAS Name: 3,5-bis[(5-hydroxy-1,5-dioxopentyl)amino]benzoic acid IUPAC Name: 3,5-bis[(5-hydroxy-5-oxopentanoyl)amino]benzoic acid Traditional Name: 3,5-bis[(5-hydroxy-5-keto-pentanoyl)amino]benzoic acid Formula: C17H20N2O8 MolecularWeight: 380.3493

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1NC(=O)CCCC(=O)O)NC(=O)CCCC(=O)O)C(=O)O

Isomeric SMILES

C1=C(C=C(C=C1NC(=O)CCCC(=O)O)NC(=O)CCCC(=O)O)C(=O)O

InChI

InChI=1S/C17H20N2O8/c20-13(3-1-5-15(22)23)18-11-7-10(17(26)27)8-12(9-11)19-14(21)4-2-6-16(24)25/h7-9H,1-6H2,(H,18,20)(H,19,21)(H,22,23)(H,24,25)(H,26,27)