5-bromanyl-3-methyl-2-[methyl-(4-pent-2-ynoxyphenyl)sulfonyl-amino]-N-oxidanyl-benzamide

Systemtic Name: 5-bromanyl-3-methyl-2-[methyl-(4-pent-2-ynoxyphenyl)sulfonyl-amino]-N-oxidanyl-benzamide Openeye Name: 5-bromo-3-methyl-2-[methyl-(4-pent-2-ynoxyphenyl)sulfonyl-amino]benzenecarbohydroxamic acid CAS Name: 5-bromo-N-hydroxy-3-methyl-2-[methyl-(4-pent-2-ynoxyphenyl)sulfonylamino]benzamide IUPAC Name: 5-bromo-N-hydroxy-3-methyl-2-[methyl-(4-pent-2-ynoxyphenyl)sulfonylamino]benzamide Traditional Name: 5-bromo-3-methyl-2-[methyl-(4-pent-2-ynoxyphenyl)sulfonyl-amino]benzenecarbohydroxamic acid Formula: C20H21BrN2O5S MolecularWeight: 481.36014

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(C=C(C=C2C(=O)NO)Br)C

Isomeric SMILES

CCC#CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2=C(C=C(C=C2C(=O)NO)Br)C

InChI

InChI=1S/C20H21BrN2O5S/c1-4-5-6-11-28-16-7-9-17(10-8-16)29(26,27)23(3)19-14(2)12-15(21)13-18(19)20(24)22-25/h7-10,12-13,25H,4,11H2,1-3H3,(H,22,24)