hexadecyl carbamate; hexanoate

Systemtic Name: hexadecyl carbamate; hexanoate Openeye Name: hexadecyl carbamate; hexanoate CAS Name: carbamic acid hexadecyl ester; hexanoate IUPAC Name: hexadecyl carbamate; hexanoate Traditional Name: carbamic acid cetyl ester; hexanoate Formula: C23H46NO4- MolecularWeight: 400.61564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)N.CCCCCC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)N.CCCCCC(=O)[O-]

InChI

InChI=1S/C17H35NO2.C6H12O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-17(18)19;1-2-3-4-5-6(7)8/h2-16H2,1H3,(H2,18,19);2-5H2,1H3,(H,7,8)/p-1