2-(octadecylcarbamoyloxymethyl)prop-2-enyl 6-imidazol-1-ylhexanoate

Systemtic Name: 2-(octadecylcarbamoyloxymethyl)prop-2-enyl 6-imidazol-1-ylhexanoate Openeye Name: 2-(octadecylcarbamoyloxymethyl)allyl 6-imidazol-1-ylhexanoate CAS Name: 6-(1-imidazolyl)hexanoic acid 2-[[(octadecylamino)-oxomethoxy]methyl]prop-2-enyl ester IUPAC Name: 2-(octadecylcarbamoyloxymethyl)prop-2-enyl 6-imidazol-1-ylhexanoate Traditional Name: 6-imidazol-1-ylhexanoic acid 2-(stearylcarbamoyloxymethyl)allyl ester Formula: C32H57N3O4 MolecularWeight: 547.81268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(=C)COC(=O)CCCCCN1C=CN=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(=C)COC(=O)CCCCCN1C=CN=C1

InChI

InChI=1S/C32H57N3O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-34-32(37)39-28-30(2)27-38-31(36)22-19-18-21-25-35-26-24-33-29-35/h24,26,29H,2-23,25,27-28H2,1H3,(H,34,37)