butyl 3-[1-(1-ethanoylperoxy-3-methyl-1-oxidanylidene-but-2-en-2-yl)-4-oxidanylidene-3-[2-(4-propan-2-ylphenoxy)ethanoylamino]azetidin-2-yl]sulfanylpropanoate

Systemtic Name: butyl 3-[1-(1-ethanoylperoxy-3-methyl-1-oxidanylidene-but-2-en-2-yl)-4-oxidanylidene-3-[2-(4-propan-2-ylphenoxy)ethanoylamino]azetidin-2-yl]sulfanylpropanoate Openeye Name: butyl 3-[1-(1-acetylperoxycarbonyl-2-methyl-prop-1-enyl)-3-[[2-(4-isopropylphenoxy)acetyl]amino]-4-oxo-azetidin-2-yl]sulfanylpropanoate CAS Name: 3-[[1-(1-acetyldioxy-3-methyl-1-oxobut-2-en-2-yl)-4-oxo-3-[[1-oxo-2-(4-propan-2-ylphenoxy)ethyl]amino]-2-azetidinyl]thio]propanoic acid butyl ester IUPAC Name: butyl 3-[1-(1-acetylperoxy-3-methyl-1-oxobut-2-en-2-yl)-4-oxo-3-[[2-(4-propan-2-ylphenoxy)acetyl]amino]azetidin-2-yl]sulfanylpropanoate Traditional Name: 3-[[1-(1-acetylperoxycarbonyl-2-methyl-prop-1-enyl)-3-[[2-(4-isopropylphenoxy)acetyl]amino]-4-keto-azetidin-2-yl]thio]propionic acid butyl ester Formula: C28H38N2O9S MolecularWeight: 578.67432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCSC1C(C(=O)N1C(=C(C)C)C(=O)OOC(=O)C)NC(=O)COC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCCCOC(=O)CCSC1C(C(=O)N1C(=C(C)C)C(=O)OOC(=O)C)NC(=O)COC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C28H38N2O9S/c1-7-8-14-36-23(33)13-15-40-27-24(26(34)30(27)25(18(4)5)28(35)39-38-19(6)31)29-22(32)16-37-21-11-9-20(10-12-21)17(2)3/h9-12,17,24,27H,7-8,13-16H2,1-6H3,(H,29,32)