4-[(11-oxidanyl-11-oxidanylidene-undecyl)amino]benzoic acid

Systemtic Name: 4-[(11-oxidanyl-11-oxidanylidene-undecyl)amino]benzoic acid Openeye Name: 4-[(11-hydroxy-11-oxo-undecyl)amino]benzoic acid CAS Name: 4-[(11-hydroxy-11-oxoundecyl)amino]benzoic acid IUPAC Name: 4-[(11-hydroxy-11-oxoundecyl)amino]benzoic acid Traditional Name: 4-[(11-hydroxy-11-keto-undecyl)amino]benzoic acid Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NCCCCCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NCCCCCCCCCCC(=O)O

InChI

InChI=1S/C18H27NO4/c20-17(21)9-7-5-3-1-2-4-6-8-14-19-16-12-10-15(11-13-16)18(22)23/h10-13,19H,1-9,14H2,(H,20,21)(H,22,23)