5-methyl-2-[(6-oxidanyl-6-oxidanylidene-hexanoyl)amino]benzoic acid

Systemtic Name: 5-methyl-2-[(6-oxidanyl-6-oxidanylidene-hexanoyl)amino]benzoic acid Openeye Name: 2-[(6-hydroxy-6-oxo-hexanoyl)amino]-5-methyl-benzoic acid CAS Name: 2-[(6-hydroxy-1,6-dioxohexyl)amino]-5-methylbenzoic acid IUPAC Name: 2-[(6-hydroxy-6-oxohexanoyl)amino]-5-methylbenzoic acid Traditional Name: 2-[(6-hydroxy-6-keto-hexanoyl)amino]-5-methyl-benzoic acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCCCC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCCCC(=O)O)C(=O)O

InChI

InChI=1S/C14H17NO5/c1-9-6-7-11(10(8-9)14(19)20)15-12(16)4-2-3-5-13(17)18/h6-8H,2-5H2,1H3,(H,15,16)(H,17,18)(H,19,20)