N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-bromanyl-2-methanoyl-phenoxy)-N-cyclopropyl-ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-bromanyl-2-methanoyl-phenoxy)-N-cyclopropyl-ethanamide Openeye Name: 2-(4-bromo-2-formyl-phenoxy)-N-cyclopropyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide CAS Name: 2-(4-bromo-2-formylphenoxy)-N-cyclopropyl-N-[(3S)-1,1-dioxo-3-thiolanyl]acetamide IUPAC Name: 2-(4-bromo-2-formylphenoxy)-N-cyclopropyl-N-[(3S)-1,1-dioxothiolan-3-yl]acetamide Traditional Name: 2-(4-bromo-2-formyl-phenoxy)-N-cyclopropyl-N-[(3S)-1,1-diketothiolan-3-yl]acetamide Formula: C16H18BrNO5S MolecularWeight: 416.28682

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C2CCS(=O)(=O)C2)C(=O)COC3=C(C=C(C=C3)Br)C=O

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1N(C2CC2)C(=O)COC3=C(C=C(C=C3)Br)C=O

InChI

InChI=1S/C16H18BrNO5S/c17-12-1-4-15(11(7-12)8-19)23-9-16(20)18(13-2-3-13)14-5-6-24(21,22)10-14/h1,4,7-8,13-14H,2-3,5-6,9-10H2/t14-/m0/s1