N-[(E)-(2-nitrophenyl)methylideneamino]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine

Systemtic Name: N-[(E)-(2-nitrophenyl)methylideneamino]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine Openeye Name: N-[(E)-(2-nitrophenyl)methyleneamino]-1,1-dioxo-1,2-benzothiazol-3-amine CAS Name: N-[(E)-(2-nitrophenyl)methylideneamino]-1,1-dioxo-1,2-benzothiazol-3-amine IUPAC Name: N-[(E)-(2-nitrophenyl)methylideneamino]-1,1-dioxo-1,2-benzothiazol-3-amine Traditional Name: (1,1-diketo-1,2-benzothiazol-3-yl)-[(E)-(2-nitrobenzylidene)amino]amine Formula: C14H10N4O4S MolecularWeight: 330.3186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NNC2=NS(=O)(=O)C3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=N/NC2=NS(=O)(=O)C3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O4S/c19-18(20)12-7-3-1-5-10(12)9-15-16-14-11-6-2-4-8-13(11)23(21,22)17-14/h1-9H,(H,16,17)/b15-9+