2-(4-nitrophenyl)-1,2-benzothiazol-3-one

Systemtic Name: 2-(4-nitrophenyl)-1,2-benzothiazol-3-one Openeye Name: 2-(4-nitrophenyl)-1,2-benzothiazol-3-one CAS Name: 2-(4-nitrophenyl)-1,2-benzothiazol-3-one IUPAC Name: 2-(4-nitrophenyl)-1,2-benzothiazol-3-one Traditional Name: 2-(4-nitrophenyl)-1,2-benzothiazol-3-one Formula: C13H8N2O3S MolecularWeight: 272.27922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H8N2O3S/c16-13-11-3-1-2-4-12(11)19-14(13)9-5-7-10(8-6-9)15(17)18/h1-8H