18-isocyanatooctadecan-7-yloxymethylbenzene

Systemtic Name: 18-isocyanatooctadecan-7-yloxymethylbenzene Openeye Name: (1-hexyl-12-isocyanato-dodecoxy)methylbenzene CAS Name: 18-isocyanatooctadecan-7-yloxymethylbenzene IUPAC Name: 18-isocyanatooctadecan-7-yloxymethylbenzene Traditional Name: (1-hexyl-12-isocyanato-dodecoxy)methylbenzene Formula: C26H43NO2 MolecularWeight: 401.62512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCCCCCCCCCCN=C=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCC(CCCCCCCCCCCN=C=O)OCC1=CC=CC=C1

InChI

InChI=1S/C26H43NO2/c1-2-3-4-15-20-26(29-23-25-18-13-12-14-19-25)21-16-10-8-6-5-7-9-11-17-22-27-24-28/h12-14,18-19,26H,2-11,15-17,20-23H2,1H3