1-chloranyl-4-isothiocyanato-2-(3-methylbut-2-enoxy)benzene

Systemtic Name: 1-chloranyl-4-isothiocyanato-2-(3-methylbut-2-enoxy)benzene Openeye Name: 1-chloro-4-isothiocyanato-2-(3-methylbut-2-enoxy)benzene CAS Name: 1-chloro-4-isothiocyanato-2-(3-methylbut-2-enoxy)benzene IUPAC Name: 1-chloro-4-isothiocyanato-2-(3-methylbut-2-enoxy)benzene Traditional Name: 1-chloro-4-isothiocyanato-2-(3-methylbut-2-enoxy)benzene Formula: C12H12ClNOS MolecularWeight: 253.74778

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=C(C=CC(=C1)N=C=S)Cl)C

Isomeric SMILES

CC(=CCOC1=C(C=CC(=C1)N=C=S)Cl)C

InChI

InChI=1S/C12H12ClNOS/c1-9(2)5-6-15-12-7-10(14-8-16)3-4-11(12)13/h3-5,7H,6H2,1-2H3