tert-butyl 2-cyclopropylcarbonyl-3-(4-methyl-1,3-benzodioxol-5-yl)-3-oxidanylidene-propanoate

Systemtic Name: tert-butyl 2-cyclopropylcarbonyl-3-(4-methyl-1,3-benzodioxol-5-yl)-3-oxidanylidene-propanoate Openeye Name: tert-butyl 2-(cyclopropanecarbonyl)-3-(4-methyl-1,3-benzodioxol-5-yl)-3-oxo-propanoate CAS Name: 2-[cyclopropyl(oxo)methyl]-3-(4-methyl-1,3-benzodioxol-5-yl)-3-oxopropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(cyclopropanecarbonyl)-3-(4-methyl-1,3-benzodioxol-5-yl)-3-oxopropanoate Traditional Name: 2-(cyclopropanecarbonyl)-3-keto-3-(4-methyl-1,3-benzodioxol-5-yl)propionic acid tert-butyl ester Formula: C19H22O6 MolecularWeight: 346.37438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OCO2)C(=O)C(C(=O)C3CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1OCO2)C(=O)C(C(=O)C3CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H22O6/c1-10-12(7-8-13-17(10)24-9-23-13)16(21)14(15(20)11-5-6-11)18(22)25-19(2,3)4/h7-8,11,14H,5-6,9H2,1-4H3