3-(4-methylphenyl)-5-nitro-1,2-benzothiazole

Systemtic Name: 3-(4-methylphenyl)-5-nitro-1,2-benzothiazole Openeye Name: 5-nitro-3-(p-tolyl)-1,2-benzothiazole CAS Name: 3-(4-methylphenyl)-5-nitro-1,2-benzothiazole IUPAC Name: 3-(4-methylphenyl)-5-nitro-1,2-benzothiazole Traditional Name: 5-nitro-3-(p-tolyl)-1,2-benzothiazole Formula: C14H10N2O2S MolecularWeight: 270.3064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NSC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NSC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N2O2S/c1-9-2-4-10(5-3-9)14-12-8-11(16(17)18)6-7-13(12)19-15-14/h2-8H,1H3