6-nitro-N-(4-nitrophenyl)-1,3-benzothiazol-2-amine

Systemtic Name: 6-nitro-N-(4-nitrophenyl)-1,3-benzothiazol-2-amine Openeye Name: 6-nitro-N-(4-nitrophenyl)-1,3-benzothiazol-2-amine CAS Name: 6-nitro-N-(4-nitrophenyl)-1,3-benzothiazol-2-amine IUPAC Name: 6-nitro-N-(4-nitrophenyl)-1,3-benzothiazol-2-amine Traditional Name: (6-nitro-1,3-benzothiazol-2-yl)-(4-nitrophenyl)amine Formula: C13H8N4O4S MolecularWeight: 316.29202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H8N4O4S/c18-16(19)9-3-1-8(2-4-9)14-13-15-11-6-5-10(17(20)21)7-12(11)22-13/h1-7H,(H,14,15)