12-[2-azanylpropyl-(12-oxidanyl-12-oxidanylidene-dodecyl)amino]dodecanoic acid

Systemtic Name: 12-[2-azanylpropyl-(12-oxidanyl-12-oxidanylidene-dodecyl)amino]dodecanoic acid Openeye Name: 12-[2-aminopropyl-(12-hydroxy-12-oxo-dodecyl)amino]dodecanoic acid CAS Name: 12-[2-aminopropyl-(12-hydroxy-12-oxododecyl)amino]dodecanoic acid IUPAC Name: 12-[2-aminopropyl-(12-hydroxy-12-oxododecyl)amino]dodecanoic acid Traditional Name: 12-[2-aminopropyl-(12-hydroxy-12-keto-dodecyl)amino]lauric acid Formula: C27H54N2O4 MolecularWeight: 470.72866

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CCCCCCCCCCCC(=O)O)CCCCCCCCCCCC(=O)O)N

Isomeric SMILES

CC(CN(CCCCCCCCCCCC(=O)O)CCCCCCCCCCCC(=O)O)N

InChI

InChI=1S/C27H54N2O4/c1-25(28)24-29(22-18-14-10-6-2-4-8-12-16-20-26(30)31)23-19-15-11-7-3-5-9-13-17-21-27(32)33/h25H,2-24,28H2,1H3,(H,30,31)(H,32,33)