N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-4-nitro-benzenesulfonamide Openeye Name: N-[(E)-(1-methylpyrrol-2-yl)methyleneamino]-4-nitro-benzenesulfonamide CAS Name: N-[(E)-(1-methyl-2-pyrrolyl)methylideneamino]-4-nitrobenzenesulfonamide IUPAC Name: N-[(E)-(1-methylpyrrol-2-yl)methylideneamino]-4-nitrobenzenesulfonamide Traditional Name: N-[(E)-(1-methylpyrrol-2-yl)methyleneamino]-4-nitro-benzenesulfonamide Formula: C12H12N4O4S MolecularWeight: 308.31308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C=NNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1/C=N/NS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O4S/c1-15-8-2-3-11(15)9-13-14-21(19,20)12-6-4-10(5-7-12)16(17)18/h2-9,14H,1H3/b13-9+