1-isothiocyanato-4-pentyl-benzene

Systemtic Name: 1-isothiocyanato-4-pentyl-benzene Openeye Name: 1-isothiocyanato-4-pentyl-benzene CAS Name: 1-isothiocyanato-4-pentylbenzene IUPAC Name: 1-isothiocyanato-4-pentylbenzene Traditional Name: 1-amyl-4-isothiocyanato-benzene Formula: C12H15NS MolecularWeight: 205.3192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)N=C=S

Isomeric SMILES

CCCCCC1=CC=C(C=C1)N=C=S

InChI

InChI=1S/C12H15NS/c1-2-3-4-5-11-6-8-12(9-7-11)13-10-14/h6-9H,2-5H2,1H3