2-[methyl-[2-[methyl-(1-oxidanyl-1-oxidanylidene-dodecan-2-yl)amino]ethyl]amino]dodecanoic acid

Systemtic Name: 2-[methyl-[2-[methyl-(1-oxidanyl-1-oxidanylidene-dodecan-2-yl)amino]ethyl]amino]dodecanoic acid Openeye Name: 2-[2-[1-carboxyundecyl(methyl)amino]ethyl-methyl-amino]dodecanoic acid CAS Name: 2-[2-[(1-hydroxy-1-oxododecan-2-yl)-methylamino]ethyl-methylamino]dodecanoic acid IUPAC Name: 2-[2-[(1-hydroxy-1-oxododecan-2-yl)-methylamino]ethyl-methylamino]dodecanoic acid Traditional Name: 2-[2-[1-carboxyundecyl(methyl)amino]ethyl-methyl-amino]lauric acid Formula: C28H56N2O4 MolecularWeight: 484.75524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(=O)O)N(C)CCN(C)C(CCCCCCCCCC)C(=O)O

Isomeric SMILES

CCCCCCCCCCC(C(=O)O)N(C)CCN(C)C(CCCCCCCCCC)C(=O)O

InChI

InChI=1S/C28H56N2O4/c1-5-7-9-11-13-15-17-19-21-25(27(31)32)29(3)23-24-30(4)26(28(33)34)22-20-18-16-14-12-10-8-6-2/h25-26H,5-24H2,1-4H3,(H,31,32)(H,33,34)