N-[(E)-(4-methoxy-3-nitro-phenyl)methylideneamino]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine

Systemtic Name: N-[(E)-(4-methoxy-3-nitro-phenyl)methylideneamino]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-amine Openeye Name: N-[(E)-(4-methoxy-3-nitro-phenyl)methyleneamino]-1,1-dioxo-1,2-benzothiazol-3-amine CAS Name: N-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-1,1-dioxo-1,2-benzothiazol-3-amine IUPAC Name: N-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-1,1-dioxo-1,2-benzothiazol-3-amine Traditional Name: (1,1-diketo-1,2-benzothiazol-3-yl)-[(E)-(4-methoxy-3-nitro-benzylidene)amino]amine Formula: C15H12N4O5S MolecularWeight: 360.34458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC2=NS(=O)(=O)C3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC2=NS(=O)(=O)C3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O5S/c1-24-13-7-6-10(8-12(13)19(20)21)9-16-17-15-11-4-2-3-5-14(11)25(22,23)18-15/h2-9H,1H3,(H,17,18)/b16-9+