(Z)-3-(3-methylphenyl)carbonyl-4-[(2-methylpropan-2-yl)oxyperoxy]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-3-(3-methylphenyl)carbonyl-4-[(2-methylpropan-2-yl)oxyperoxy]-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-3-tert-butoxyperoxycarbonyl-4-(m-tolyl)-4-oxo-but-2-enoic acid CAS Name: (Z)-3-[(3-methylphenyl)-oxomethyl]-4-[(2-methylpropan-2-yl)oxydioxy]-4-oxo-2-butenoic acid IUPAC Name: (Z)-3-(3-methylbenzoyl)-4-[(2-methylpropan-2-yl)oxyperoxy]-4-oxobut-2-enoic acid Traditional Name: (Z)-3-tert-butoxyperoxycarbonyl-4-keto-4-(m-tolyl)but-2-enoic acid Formula: C16H18O7 MolecularWeight: 322.30992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C(=CC(=O)O)C(=O)OOOC(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)/C(=C/C(=O)O)/C(=O)OOOC(C)(C)C

InChI

InChI=1S/C16H18O7/c1-10-6-5-7-11(8-10)14(19)12(9-13(17)18)15(20)21-23-22-16(2,3)4/h5-9H,1-4H3,(H,17,18)/b12-9-