diethyl (3E,4Z)-3-[(1-oxidanylcyclohexyl)methylidene]-4-(phenylmethylidene)cyclopentane-1,1-dicarboxylate

Systemtic Name: diethyl (3E,4Z)-3-[(1-oxidanylcyclohexyl)methylidene]-4-(phenylmethylidene)cyclopentane-1,1-dicarboxylate Openeye Name: diethyl (3Z,4E)-3-benzylidene-4-[(1-hydroxycyclohexyl)methylene]cyclopentane-1,1-dicarboxylate CAS Name: (3E,4Z)-3-[(1-hydroxycyclohexyl)methylidene]-4-(phenylmethylene)cyclopentane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl (3Z,4E)-3-benzylidene-4-[(1-hydroxycyclohexyl)methylidene]cyclopentane-1,1-dicarboxylate Traditional Name: (3Z,4E)-3-benzal-4-[(1-hydroxycyclohexyl)methylene]cyclopentane-1,1-dicarboxylic acid diethyl ester Formula: C25H32O5 MolecularWeight: 412.51858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(=CC2=CC=CC=C2)C(=CC3(CCCCC3)O)C1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(C/C(=C/C2=CC=CC=C2)/C(=C/C3(CCCCC3)O)/C1)C(=O)OCC

InChI

InChI=1S/C25H32O5/c1-3-29-22(26)25(23(27)30-4-2)17-20(15-19-11-7-5-8-12-19)21(18-25)16-24(28)13-9-6-10-14-24/h5,7-8,11-12,15-16,28H,3-4,6,9-10,13-14,17-18H2,1-2H3/b20-15-,21-16+