13-oxidanylidene-13-[2-[3-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]ethylamino]tridecanoic acid

Systemtic Name: 13-oxidanylidene-13-[2-[3-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]ethylamino]tridecanoic acid Openeye Name: 13-[2-[3-(4-hydroxy-4-oxo-butoxy)phenyl]ethylamino]-13-oxo-tridecanoic acid CAS Name: 13-[2-[3-(4-hydroxy-4-oxobutoxy)phenyl]ethylamino]-13-oxotridecanoic acid IUPAC Name: 13-[2-[3-(4-hydroxy-4-oxobutoxy)phenyl]ethylamino]-13-oxotridecanoic acid Traditional Name: 13-[2-[3-(4-hydroxy-4-keto-butoxy)phenyl]ethylamino]-13-keto-tridecanoic acid Formula: C25H39NO6 MolecularWeight: 449.58026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCC(=O)O)CCNC(=O)CCCCCCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OCCCC(=O)O)CCNC(=O)CCCCCCCCCCCC(=O)O

InChI

InChI=1S/C25H39NO6/c27-23(14-8-6-4-2-1-3-5-7-9-15-24(28)29)26-18-17-21-12-10-13-22(20-21)32-19-11-16-25(30)31/h10,12-13,20H,1-9,11,14-19H2,(H,26,27)(H,28,29)(H,30,31)