N-[4-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-(oxidanylamino)-5-oxidanylidene-pentyl]benzamide

Systemtic Name: N-[4-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-(oxidanylamino)-5-oxidanylidene-pentyl]benzamide Openeye Name: N-[4-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-(hydroxyamino)-5-oxo-pentyl]benzamide CAS Name: N-[4-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-(hydroxyamino)-5-oxopentyl]benzamide IUPAC Name: N-[4-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-(hydroxyamino)-5-oxopentyl]benzamide Traditional Name: N-[4-[(4-but-2-ynoxyphenyl)sulfonylamino]-5-(hydroxyamino)-5-keto-pentyl]benzamide Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CCCNC(=O)C2=CC=CC=C2)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)NC(CCCNC(=O)C2=CC=CC=C2)C(=O)NO

InChI

InChI=1S/C22H25N3O6S/c1-2-3-16-31-18-11-13-19(14-12-18)32(29,30)25-20(22(27)24-28)10-7-15-23-21(26)17-8-5-4-6-9-17/h4-6,8-9,11-14,20,25,28H,7,10,15-16H2,1H3,(H,23,26)(H,24,27)