but-2-ynoxybenzene; N-oxidanyl-1-(phenylmethyl)-4-(sulfonylmethyl)piperidine-4-carboxamide

Systemtic Name: but-2-ynoxybenzene; N-oxidanyl-1-(phenylmethyl)-4-(sulfonylmethyl)piperidine-4-carboxamide Openeye Name: 1-benzyl-4-(sulfonylmethyl)piperidine-4-carbohydroxamic acid; but-2-ynoxybenzene CAS Name: but-2-ynoxybenzene; N-hydroxy-1-(phenylmethyl)-4-(sulfonylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-benzyl-N-hydroxy-4-(sulfonylmethyl)piperidine-4-carboxamide; but-2-ynoxybenzene Traditional Name: 1-benzyl-4-(sulfonylmethyl)piperidine-4-carbohydroxamic acid; but-2-ynoxybenzene Formula: C24H28N2O5S MolecularWeight: 456.55452

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=CC=C1.C1CN(CCC1(C=S(=O)=O)C(=O)NO)CC2=CC=CC=C2

Isomeric SMILES

CC#CCOC1=CC=CC=C1.C1CN(CCC1(C=S(=O)=O)C(=O)NO)CC2=CC=CC=C2

InChI

InChI=1S/C14H18N2O4S.C10H10O/c17-13(15-18)14(11-21(19)20)6-8-16(9-7-14)10-12-4-2-1-3-5-12;1-2-3-9-11-10-7-5-4-6-8-10/h1-5,11,18H,6-10H2,(H,15,17);4-8H,9H2,1H3