(phenylmethyl) N-[1-(4-methoxyphenyl)sulfonyl-2-(oxidanylcarbamoyl)azepan-3-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(4-methoxyphenyl)sulfonyl-2-(oxidanylcarbamoyl)azepan-3-yl]carbamate Openeye Name: benzyl N-[2-(hydroxycarbamoyl)-1-(4-methoxyphenyl)sulfonyl-azepan-3-yl]carbamate CAS Name: N-[2-[(hydroxyamino)-oxomethyl]-1-(4-methoxyphenyl)sulfonyl-3-azepanyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-(hydroxycarbamoyl)-1-(4-methoxyphenyl)sulfonylazepan-3-yl]carbamate Traditional Name: N-[2-(hydroxycarbamoyl)-1-(4-methoxyphenyl)sulfonyl-azepan-3-yl]carbamic acid benzyl ester Formula: C22H27N3O7S MolecularWeight: 477.53068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCCC(C2C(=O)NO)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCCC(C2C(=O)NO)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O7S/c1-31-17-10-12-18(13-11-17)33(29,30)25-14-6-5-9-19(20(25)21(26)24-28)23-22(27)32-15-16-7-3-2-4-8-16/h2-4,7-8,10-13,19-20,28H,5-6,9,14-15H2,1H3,(H,23,27)(H,24,26)