1-isothiocyanato-2-methyl-4-nitro-benzene

Systemtic Name: 1-isothiocyanato-2-methyl-4-nitro-benzene Openeye Name: 1-isothiocyanato-2-methyl-4-nitro-benzene CAS Name: 1-isothiocyanato-2-methyl-4-nitrobenzene IUPAC Name: 1-isothiocyanato-2-methyl-4-nitrobenzene Traditional Name: 1-isothiocyanato-2-methyl-4-nitro-benzene Formula: C8H6N2O2S MolecularWeight: 194.21044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])N=C=S

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])N=C=S

InChI

InChI=1S/C8H6N2O2S/c1-6-4-7(10(11)12)2-3-8(6)9-5-13/h2-4H,1H3