1-isothiocyanatohepta-1,2,6-triene

Systemtic Name: 1-isothiocyanatohepta-1,2,6-triene Openeye Name: 1-isothiocyanatohepta-1,2,6-triene CAS Name: 1-isothiocyanatohepta-1,2,6-triene IUPAC Name: 1-isothiocyanatohepta-1,2,6-triene Traditional Name: 1-isothiocyanatohepta-1,2,6-triene Formula: C8H9NS MolecularWeight: 151.22876

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC=C=CN=C=S

Isomeric SMILES

C=CCCC=C=CN=C=S

InChI

InChI=1S/C8H9NS/c1-2-3-4-5-6-7-9-8-10/h2,5,7H,1,3-4H2