(Z)-1,16-diisothiocyanatohexadec-1-ene

Systemtic Name: (Z)-1,16-diisothiocyanatohexadec-1-ene Openeye Name: (Z)-1,16-diisothiocyanatohexadec-1-ene CAS Name: (Z)-1,16-diisothiocyanato-1-hexadecene IUPAC Name: (Z)-1,16-diisothiocyanatohexadec-1-ene Traditional Name: (Z)-1,16-diisothiocyanatohexadec-1-ene Formula: C18H30N2S2 MolecularWeight: 338.5742

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCCCN=C=S)CCCCCCC=CN=C=S

Isomeric SMILES

C(CCCCCCCN=C=S)CCCCCC/C=C\N=C=S

InChI

InChI=1S/C18H30N2S2/c21-17-19-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-20-18-22/h13,15H,1-12,14,16H2/b15-13-