tetradecyl 3-[2-imidazol-1-ylethyl-(3-oxidanylidene-3-tetradecoxy-propyl)amino]propanoate

Systemtic Name: tetradecyl 3-[2-imidazol-1-ylethyl-(3-oxidanylidene-3-tetradecoxy-propyl)amino]propanoate Openeye Name: tetradecyl 3-[2-imidazol-1-ylethyl-(3-oxo-3-tetradecoxy-propyl)amino]propanoate CAS Name: 3-[2-(1-imidazolyl)ethyl-(3-oxo-3-tetradecoxypropyl)amino]propanoic acid tetradecyl ester IUPAC Name: tetradecyl 3-[2-imidazol-1-ylethyl-(3-oxo-3-tetradecoxypropyl)amino]propanoate Traditional Name: 3-[2-imidazol-1-ylethyl-(3-keto-3-myristyloxy-propyl)amino]propionic acid myristyl ester Formula: C39H73N3O4 MolecularWeight: 648.01462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)CCN(CCC(=O)OCCCCCCCCCCCCCC)CCN1C=CN=C1

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)CCN(CCC(=O)OCCCCCCCCCCCCCC)CCN1C=CN=C1

InChI

InChI=1S/C39H73N3O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-35-45-38(43)27-30-41(33-34-42-32-29-40-37-42)31-28-39(44)46-36-26-24-22-20-18-16-14-12-10-8-6-4-2/h29,32,37H,3-28,30-31,33-36H2,1-2H3