O1-(2,2-dimethyl-3-oxidanyl-propyl) O3-propan-2-yl 4-(1,3-benzodioxol-5-yl)cyclopent-3-ene-1,3-dicarboxylate

Systemtic Name: O1-(2,2-dimethyl-3-oxidanyl-propyl) O3-propan-2-yl 4-(1,3-benzodioxol-5-yl)cyclopent-3-ene-1,3-dicarboxylate Openeye Name: O1-(3-hydroxy-2,2-dimethyl-propyl) O3-isopropyl 4-(1,3-benzodioxol-5-yl)cyclopent-3-ene-1,3-dicarboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)cyclopent-3-ene-1,3-dicarboxylic acid O1-(3-hydroxy-2,2-dimethylpropyl) ester O3-propan-2-yl ester IUPAC Name: 1-O-(3-hydroxy-2,2-dimethylpropyl) 3-O-propan-2-yl 4-(1,3-benzodioxol-5-yl)cyclopent-3-ene-1,3-dicarboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)cyclopent-3-ene-1,3-dicarboxylic acid O1-(3-hydroxy-2,2-dimethyl-propyl) ester O3-isopropyl ester Formula: C22H28O7 MolecularWeight: 404.45352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(CC(C1)C(=O)OCC(C)(C)CO)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)OC(=O)C1=C(CC(C1)C(=O)OCC(C)(C)CO)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C22H28O7/c1-13(2)29-21(25)17-8-15(20(24)26-11-22(3,4)10-23)7-16(17)14-5-6-18-19(9-14)28-12-27-18/h5-6,9,13,15,23H,7-8,10-12H2,1-4H3