2-(4-bromophenyl)-N-oxidanyl-2-sulfinyl-ethanamide; but-2-ynoxybenzene

Systemtic Name: 2-(4-bromophenyl)-N-oxidanyl-2-sulfinyl-ethanamide; but-2-ynoxybenzene Openeye Name: 2-(4-bromophenyl)-2-sulfinyl-ethanehydroxamic acid; but-2-ynoxybenzene CAS Name: 2-(4-bromophenyl)-N-hydroxy-2-sulfinylacetamide; but-2-ynoxybenzene IUPAC Name: 2-(4-bromophenyl)-N-hydroxy-2-sulfinylacetamide; but-2-ynoxybenzene Traditional Name: 2-(4-bromophenyl)-2-sulfinyl-ethanehydroxamic acid; but-2-ynoxybenzene Formula: C18H16BrNO4S MolecularWeight: 422.29294

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=CC=C1.C1=CC(=CC=C1C(=S=O)C(=O)NO)Br

Isomeric SMILES

CC#CCOC1=CC=CC=C1.C1=CC(=CC=C1C(=S=O)C(=O)NO)Br

InChI

InChI=1S/C10H10O.C8H6BrNO3S/c1-2-3-9-11-10-7-5-4-6-8-10;9-6-3-1-5(2-4-6)7(14-13)8(11)10-12/h4-8H,9H2,1H3;1-4,12H,(H,10,11)