3-(4-but-2-ynoxyphenyl)-1-[(4-chlorophenyl)methyl]-N-oxidanyl-2-sulfonyl-piperidine-3-carboxamide

Systemtic Name: 3-(4-but-2-ynoxyphenyl)-1-[(4-chlorophenyl)methyl]-N-oxidanyl-2-sulfonyl-piperidine-3-carboxamide Openeye Name: 3-(4-but-2-ynoxyphenyl)-1-[(4-chlorophenyl)methyl]-2-sulfonyl-piperidine-3-carbohydroxamic acid CAS Name: 3-(4-but-2-ynoxyphenyl)-1-[(4-chlorophenyl)methyl]-N-hydroxy-2-sulfonyl-3-piperidinecarboxamide IUPAC Name: 3-(4-but-2-ynoxyphenyl)-1-[(4-chlorophenyl)methyl]-N-hydroxy-2-sulfonylpiperidine-3-carboxamide Traditional Name: 3-(4-but-2-ynoxyphenyl)-1-(4-chlorobenzyl)-2-sulfonyl-piperidine-3-carbohydroxamic acid Formula: C23H23ClN2O5S MolecularWeight: 474.95712

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)C2(CCCN(C2=S(=O)=O)CC3=CC=C(C=C3)Cl)C(=O)NO

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)C2(CCCN(C2=S(=O)=O)CC3=CC=C(C=C3)Cl)C(=O)NO

InChI

InChI=1S/C23H23ClN2O5S/c1-2-3-15-31-20-11-7-18(8-12-20)23(21(27)25-28)13-4-14-26(22(23)32(29)30)16-17-5-9-19(24)10-6-17/h5-12,28H,4,13-16H2,1H3,(H,25,27)