dimethyl (4E)-3-[(E)-4-ethoxy-4-oxidanylidene-but-2-enyl]-4-(phenylmethylidene)cyclopentane-1,1-dicarboxylate

Systemtic Name: dimethyl (4E)-3-[(E)-4-ethoxy-4-oxidanylidene-but-2-enyl]-4-(phenylmethylidene)cyclopentane-1,1-dicarboxylate Openeye Name: dimethyl (3E)-3-benzylidene-4-[(E)-4-ethoxy-4-oxo-but-2-enyl]cyclopentane-1,1-dicarboxylate CAS Name: (4E)-3-[(E)-4-ethoxy-4-oxobut-2-enyl]-4-(phenylmethylene)cyclopentane-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (3E)-3-benzylidene-4-[(E)-4-ethoxy-4-oxobut-2-enyl]cyclopentane-1,1-dicarboxylate Traditional Name: (3E)-3-benzal-4-[(E)-4-ethoxy-4-keto-but-2-enyl]cyclopentane-1,1-dicarboxylic acid dimethyl ester Formula: C22H26O6 MolecularWeight: 386.43824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCC1CC(CC1=CC2=CC=CC=C2)(C(=O)OC)C(=O)OC

Isomeric SMILES

CCOC(=O)/C=C/CC\1CC(C/C1=C\C2=CC=CC=C2)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C22H26O6/c1-4-28-19(23)12-8-11-17-14-22(20(24)26-2,21(25)27-3)15-18(17)13-16-9-6-5-7-10-16/h5-10,12-13,17H,4,11,14-15H2,1-3H3/b12-8+,18-13+