dimethyl (3E)-3-(1-acetyloxyoctylidene)-4-(2-oxidanylideneethyl)cyclopentane-1,1-dicarboxylate

Systemtic Name: dimethyl (3E)-3-(1-acetyloxyoctylidene)-4-(2-oxidanylideneethyl)cyclopentane-1,1-dicarboxylate Openeye Name: dimethyl (3E)-3-(1-acetoxyoctylidene)-4-(2-oxoethyl)cyclopentane-1,1-dicarboxylate CAS Name: (3E)-3-(1-acetyloxyoctylidene)-4-(2-oxoethyl)cyclopentane-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (3E)-3-(1-acetyloxyoctylidene)-4-(2-oxoethyl)cyclopentane-1,1-dicarboxylate Traditional Name: (3E)-3-(1-acetoxyoctylidene)-4-(2-ketoethyl)cyclopentane-1,1-dicarboxylic acid dimethyl ester Formula: C21H32O7 MolecularWeight: 396.47458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=C1CC(CC1CC=O)(C(=O)OC)C(=O)OC)OC(=O)C

Isomeric SMILES

CCCCCCC/C(=C\1/CC(CC1CC=O)(C(=O)OC)C(=O)OC)/OC(=O)C

InChI

InChI=1S/C21H32O7/c1-5-6-7-8-9-10-18(28-15(2)23)17-14-21(19(24)26-3,20(25)27-4)13-16(17)11-12-22/h12,16H,5-11,13-14H2,1-4H3/b18-17+