[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-cyclopropyl-amino]-2-oxidanylidene-ethyl] 2-bromanylbenzoate

Systemtic Name: [2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-cyclopropyl-amino]-2-oxidanylidene-ethyl] 2-bromanylbenzoate Openeye Name: [2-[cyclopropyl-(1,1-dioxothiolan-3-yl)amino]-2-oxo-ethyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [2-[cyclopropyl-(1,1-dioxo-3-thiolanyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclopropyl-(1,1-dioxothiolan-3-yl)amino]-2-oxoethyl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [2-[cyclopropyl-(1,1-diketothiolan-3-yl)amino]-2-keto-ethyl] ester Formula: C16H18BrNO5S MolecularWeight: 416.28682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C2CCS(=O)(=O)C2)C(=O)COC(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1CC1N(C2CCS(=O)(=O)C2)C(=O)COC(=O)C3=CC=CC=C3Br

InChI

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