4-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]-N-(3-oxidanylidenebutyl)benzenesulfonamide

Systemtic Name: 4-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]-N-(3-oxidanylidenebutyl)benzenesulfonamide Openeye Name: 4-methyl-N-[(E)-(4-nitrophenyl)methyleneamino]-N-(3-oxobutyl)benzenesulfonamide CAS Name: 4-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]-N-(3-oxobutyl)benzenesulfonamide IUPAC Name: 4-methyl-N-[(E)-(4-nitrophenyl)methylideneamino]-N-(3-oxobutyl)benzenesulfonamide Traditional Name: N-(3-ketobutyl)-4-methyl-N-[(E)-(4-nitrobenzylidene)amino]benzenesulfonamide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)C)N=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)C)/N=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c1-14-3-9-18(10-4-14)27(25,26)20(12-11-15(2)22)19-13-16-5-7-17(8-6-16)21(23)24/h3-10,13H,11-12H2,1-2H3/b19-13+