N-(2-methoxyphenyl)-3-nitro-4-[(2E)-2-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]benzenesulfonamide

Systemtic Name: N-(2-methoxyphenyl)-3-nitro-4-[(2E)-2-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]benzenesulfonamide Openeye Name: N-(2-methoxyphenyl)-3-nitro-4-[(2E)-2-[(6-nitro-1,3-benzodioxol-5-yl)methylene]hydrazino]benzenesulfonamide CAS Name: N-(2-methoxyphenyl)-3-nitro-4-[(2E)-2-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]benzenesulfonamide IUPAC Name: N-(2-methoxyphenyl)-3-nitro-4-[(2E)-2-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]benzenesulfonamide Traditional Name: N-(2-methoxyphenyl)-3-nitro-4-[(N'E)-N'-[(6-nitro-1,3-benzodioxol-5-yl)methylene]hydrazino]benzenesulfonamide Formula: C21H17N5O9S MolecularWeight: 515.45278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)NN=CC3=CC4=C(C=C3[N+](=O)[O-])OCO4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)N/N=C/C3=CC4=C(C=C3[N+](=O)[O-])OCO4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O9S/c1-33-19-5-3-2-4-16(19)24-36(31,32)14-6-7-15(18(9-14)26(29)30)23-22-11-13-8-20-21(35-12-34-20)10-17(13)25(27)28/h2-11,23-24H,12H2,1H3/b22-11+