4-[(2E)-2-[(4-butoxyphenyl)methylidene]hydrazinyl]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2E)-2-[(4-butoxyphenyl)methylidene]hydrazinyl]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[(2E)-2-[(4-butoxyphenyl)methylene]hydrazino]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[(2E)-2-[(4-butoxyphenyl)methylidene]hydrazinyl]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2E)-2-[(4-butoxyphenyl)methylidene]hydrazinyl]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(N'E)-N'-(4-butoxybenzylidene)hydrazino]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O5S/c1-4-7-14-30-18-10-8-17(9-11-18)16-22-23-20-13-12-19(15-21(20)25(26)27)31(28,29)24(5-2)6-3/h8-13,15-16,23H,4-7,14H2,1-3H3/b22-16+