N-[4-[2-methyl-2-oxidanyl-3-(oxidanylamino)-3-oxidanylidene-propyl]sulfonylphenyl]-3-(4-oxidanylbutylamino)benzamide

Systemtic Name: N-[4-[2-methyl-2-oxidanyl-3-(oxidanylamino)-3-oxidanylidene-propyl]sulfonylphenyl]-3-(4-oxidanylbutylamino)benzamide Openeye Name: 3-(4-hydroxybutylamino)-N-[4-[2-hydroxy-3-(hydroxyamino)-2-methyl-3-oxo-propyl]sulfonylphenyl]benzamide CAS Name: 3-(4-hydroxybutylamino)-N-[4-[2-hydroxy-3-(hydroxyamino)-2-methyl-3-oxopropyl]sulfonylphenyl]benzamide IUPAC Name: 3-(4-hydroxybutylamino)-N-[4-[2-hydroxy-3-(hydroxyamino)-2-methyl-3-oxopropyl]sulfonylphenyl]benzamide Traditional Name: 3-(4-hydroxybutylamino)-N-[4-[2-hydroxy-3-(hydroxyamino)-3-keto-2-methyl-propyl]sulfonylphenyl]benzamide Formula: C21H27N3O7S MolecularWeight: 465.51998

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)NCCCCO)(C(=O)NO)O

Isomeric SMILES

CC(CS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)NCCCCO)(C(=O)NO)O

InChI

InChI=1S/C21H27N3O7S/c1-21(28,20(27)24-29)14-32(30,31)18-9-7-16(8-10-18)23-19(26)15-5-4-6-17(13-15)22-11-2-3-12-25/h4-10,13,22,25,28-29H,2-3,11-12,14H2,1H3,(H,23,26)(H,24,27)