12-[[5-methyl-2-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]amino]-12-oxidanylidene-dodecanoic acid

Systemtic Name: 12-[[5-methyl-2-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]amino]-12-oxidanylidene-dodecanoic acid Openeye Name: 12-[2-(4-hydroxy-4-oxo-butoxy)-5-methyl-anilino]-12-oxo-dodecanoic acid CAS Name: 12-[2-(4-hydroxy-4-oxobutoxy)-5-methylanilino]-12-oxododecanoic acid IUPAC Name: 12-[2-(4-hydroxy-4-oxobutoxy)-5-methylanilino]-12-oxododecanoic acid Traditional Name: 12-[2-(4-hydroxy-4-keto-butoxy)-5-methyl-anilino]-12-keto-lauric acid Formula: C23H35NO6 MolecularWeight: 421.5271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCC(=O)O)NC(=O)CCCCCCCCCCC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCC(=O)O)NC(=O)CCCCCCCCCCC(=O)O

InChI

InChI=1S/C23H35NO6/c1-18-14-15-20(30-16-10-13-23(28)29)19(17-18)24-21(25)11-8-6-4-2-3-5-7-9-12-22(26)27/h14-15,17H,2-13,16H2,1H3,(H,24,25)(H,26,27)(H,28,29)