4-chloranyl-3-[(5-oxidanyl-5-oxidanylidene-pentanoyl)amino]benzoic acid

Systemtic Name: 4-chloranyl-3-[(5-oxidanyl-5-oxidanylidene-pentanoyl)amino]benzoic acid Openeye Name: 4-chloro-3-[(5-hydroxy-5-oxo-pentanoyl)amino]benzoic acid CAS Name: 4-chloro-3-[(5-hydroxy-1,5-dioxopentyl)amino]benzoic acid IUPAC Name: 4-chloro-3-[(5-hydroxy-5-oxopentanoyl)amino]benzoic acid Traditional Name: 4-chloro-3-[(5-hydroxy-5-keto-pentanoyl)amino]benzoic acid Formula: C12H12ClNO5 MolecularWeight: 285.68038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NC(=O)CCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NC(=O)CCCC(=O)O)Cl

InChI

InChI=1S/C12H12ClNO5/c13-8-5-4-7(12(18)19)6-9(8)14-10(15)2-1-3-11(16)17/h4-6H,1-3H2,(H,14,15)(H,16,17)(H,18,19)