3-[[4-[2-cyanoethyl(phenylsulfonyl)amino]phenyl]methylideneamino]-N-oxidanyl-benzeneamine oxide

Systemtic Name: 3-[[4-[2-cyanoethyl(phenylsulfonyl)amino]phenyl]methylideneamino]-N-oxidanyl-benzeneamine oxide Openeye Name: 3-[[4-[benzenesulfonyl(2-cyanoethyl)amino]phenyl]methyleneamino]-N-hydroxy-benzeneamine oxide CAS Name: 3-[[4-[benzenesulfonyl(2-cyanoethyl)amino]phenyl]methylideneamino]-N-hydroxybenzeneamine oxide IUPAC Name: 3-[[4-[benzenesulfonyl(2-cyanoethyl)amino]phenyl]methylideneamino]-N-hydroxybenzeneamine oxide Traditional Name: 3-[[4-[besyl(2-cyanoethyl)amino]benzylidene]amino]-N-hydroxy-benzeneamine oxide Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CCC#N)C2=CC=C(C=C2)C=NC3=CC(=CC=C3)[NH+](O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CCC#N)C2=CC=C(C=C2)C=NC3=CC(=CC=C3)[NH+](O)[O-]

InChI

InChI=1S/C22H20N4O4S/c23-14-5-15-25(31(29,30)22-8-2-1-3-9-22)20-12-10-18(11-13-20)17-24-19-6-4-7-21(16-19)26(27)28/h1-4,6-13,16-17,26-27H,5,15H2