4-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[(2E)-2-(1,3-benzodioxol-5-ylmethylene)hydrazino]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-3-nitro-4-[(N'E)-N'-piperonylidenehydrazino]benzenesulfonamide Formula: C18H20N4O6S MolecularWeight: 420.4396

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NN=CC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N/N=C/C2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O6S/c1-3-21(4-2)29(25,26)14-6-7-15(16(10-14)22(23)24)20-19-11-13-5-8-17-18(9-13)28-12-27-17/h5-11,20H,3-4,12H2,1-2H3/b19-11+