N-(1,3-benzothiazol-2-yl)-4-methoxy-3-nitro-benzenesulfonamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-methoxy-3-nitro-benzenesulfonamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-methoxy-3-nitro-benzenesulfonamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-methoxy-3-nitrobenzenesulfonamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-methoxy-3-nitrobenzenesulfonamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-methoxy-3-nitro-benzenesulfonamide Formula: C14H11N3O5S2 MolecularWeight: 365.38424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3S2)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O5S2/c1-22-12-7-6-9(8-11(12)17(18)19)24(20,21)16-14-15-10-4-2-3-5-13(10)23-14/h2-8H,1H3,(H,15,16)