1-(4-methoxyphenyl)sulfonyl-N2-oxidanyl-N3-phenethyl-azepane-2,3-dicarboxamide

Systemtic Name: 1-(4-methoxyphenyl)sulfonyl-N2-oxidanyl-N3-phenethyl-azepane-2,3-dicarboxamide Openeye Name: 2-(hydroxycarbamoyl)-1-(4-methoxyphenyl)sulfonyl-N-phenethyl-azepane-3-carboxamide CAS Name: N2-hydroxy-1-(4-methoxyphenyl)sulfonyl-N3-phenethylazepane-2,3-dicarboxamide IUPAC Name: 2-N-hydroxy-1-(4-methoxyphenyl)sulfonyl-3-N-phenethylazepane-2,3-dicarboxamide Traditional Name: 2-(hydroxycarbamoyl)-1-(4-methoxyphenyl)sulfonyl-N-phenethyl-azepane-3-carboxamide Formula: C23H29N3O6S MolecularWeight: 475.55786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCCC(C2C(=O)NO)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCCC(C2C(=O)NO)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O6S/c1-32-18-10-12-19(13-11-18)33(30,31)26-16-6-5-9-20(21(26)23(28)25-29)22(27)24-15-14-17-7-3-2-4-8-17/h2-4,7-8,10-13,20-21,29H,5-6,9,14-16H2,1H3,(H,24,27)(H,25,28)