1,2-bis(bromomethyl)-4-isothiocyanato-benzene

Systemtic Name: 1,2-bis(bromomethyl)-4-isothiocyanato-benzene Openeye Name: 1,2-bis(bromomethyl)-4-isothiocyanato-benzene CAS Name: 1,2-bis(bromomethyl)-4-isothiocyanatobenzene IUPAC Name: 1,2-bis(bromomethyl)-4-isothiocyanatobenzene Traditional Name: 1,2-bis(bromomethyl)-4-isothiocyanato-benzene Formula: C9H7Br2NS MolecularWeight: 321.03158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N=C=S)CBr)CBr

Isomeric SMILES

C1=CC(=C(C=C1N=C=S)CBr)CBr

InChI

InChI=1S/C9H7Br2NS/c10-4-7-1-2-9(12-6-13)3-8(7)5-11/h1-3H,4-5H2