4-[(2E)-2-[(4-butoxy-3-methoxy-phenyl)methylidene]hydrazinyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2E)-2-[(4-butoxy-3-methoxy-phenyl)methylidene]hydrazinyl]-3-nitro-benzenesulfonamide Openeye Name: 4-[(2E)-2-[(4-butoxy-3-methoxy-phenyl)methylene]hydrazino]-3-nitro-benzenesulfonamide CAS Name: 4-[(2E)-2-[(4-butoxy-3-methoxyphenyl)methylidene]hydrazinyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2E)-2-[(4-butoxy-3-methoxyphenyl)methylidene]hydrazinyl]-3-nitrobenzenesulfonamide Traditional Name: 4-[(N'E)-N'-(4-butoxy-3-methoxy-benzylidene)hydrazino]-3-nitro-benzenesulfonamide Formula: C18H22N4O6S MolecularWeight: 422.45548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=NNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=N/NC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])OC

InChI

InChI=1S/C18H22N4O6S/c1-3-4-9-28-17-8-5-13(10-18(17)27-2)12-20-21-15-7-6-14(29(19,25)26)11-16(15)22(23)24/h5-8,10-12,21H,3-4,9H2,1-2H3,(H2,19,25,26)/b20-12+