1-isocyanatohexadecan-1-one

Systemtic Name: 1-isocyanatohexadecan-1-one Openeye Name: hexadecanoyl isocyanate CAS Name: 1-isocyanato-1-hexadecanone IUPAC Name: hexadecanoyl isocyanate Traditional Name: 1-isocyanatohexadecan-1-one Formula: C17H31NO2 MolecularWeight: 281.43354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)N=C=O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N=C=O

InChI

InChI=1S/C17H31NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(20)18-16-19/h2-15H2,1H3