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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)N/N=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

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