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

Systemtic Name: 12-[2-azanylpropyl-(12-oxidanylidene-12-tetradecoxy-dodecyl)amino]dodecanoic acid Openeye Name: 12-[2-aminopropyl-(12-oxo-12-tetradecoxy-dodecyl)amino]dodecanoic acid CAS Name: 12-[2-aminopropyl-(12-oxo-12-tetradecoxydodecyl)amino]dodecanoic acid IUPAC Name: 12-[2-aminopropyl-(12-oxo-12-tetradecoxydodecyl)amino]dodecanoic acid Traditional Name: 12-[2-aminopropyl-(12-keto-12-myristyloxy-dodecyl)amino]lauric acid Formula: C41H82N2O4 MolecularWeight: 667.10078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCN(CCCCCCCCCCCC(=O)O)CC(C)N

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)CCCCCCCCCCCN(CCCCCCCCCCCC(=O)O)CC(C)N

InChI

InChI=1S/C41H82N2O4/c1-3-4-5-6-7-8-9-10-17-22-27-32-37-47-41(46)34-29-24-19-14-12-16-21-26-31-36-43(38-39(2)42)35-30-25-20-15-11-13-18-23-28-33-40(44)45/h39H,3-38,42H2,1-2H3,(H,44,45)