4-[(2E)-2-[1-(1,3-benzodioxol-5-yl)ethylidene]hydrazinyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2E)-2-[1-(1,3-benzodioxol-5-yl)ethylidene]hydrazinyl]-3-nitro-benzenesulfonamide Openeye Name: 4-[(2E)-2-[1-(1,3-benzodioxol-5-yl)ethylidene]hydrazino]-3-nitro-benzenesulfonamide CAS Name: 4-[(2E)-2-[1-(1,3-benzodioxol-5-yl)ethylidene]hydrazinyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2E)-2-[1-(1,3-benzodioxol-5-yl)ethylidene]hydrazinyl]-3-nitrobenzenesulfonamide Traditional Name: 4-[(N'E)-N'-[1-(1,3-benzodioxol-5-yl)ethylidene]hydrazino]-3-nitro-benzenesulfonamide Formula: C15H14N4O6S MolecularWeight: 378.35986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-])C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=N\NC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-])/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H14N4O6S/c1-9(10-2-5-14-15(6-10)25-8-24-14)17-18-12-4-3-11(26(16,22)23)7-13(12)19(20)21/h2-7,18H,8H2,1H3,(H2,16,22,23)/b17-9+