(2E,6E)-2,6-bis[(3-chloranyl-5-ethoxy-4-propoxy-phenyl)methylidene]cyclohexan-1-one

Systemtic Name: (2E,6E)-2,6-bis[(3-chloranyl-5-ethoxy-4-propoxy-phenyl)methylidene]cyclohexan-1-one Openeye Name: (2E,6E)-2,6-bis[(3-chloro-5-ethoxy-4-propoxy-phenyl)methylene]cyclohexanone CAS Name: (2E,6E)-2,6-bis[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]-1-cyclohexanone IUPAC Name: (2E,6E)-2,6-bis[(3-chloro-5-ethoxy-4-propoxyphenyl)methylidene]cyclohexan-1-one Traditional Name: (2E,6E)-2,6-bis(3-chloro-5-ethoxy-4-propoxy-benzylidene)cyclohexanone Formula: C30H36Cl2O5 MolecularWeight: 547.50984

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C=C2CCCC(=CC3=CC(=C(C(=C3)Cl)OCCC)OCC)C2=O)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)/C=C\2/C(=O)/C(=C/C3=CC(=C(C(=C3)Cl)OCCC)OCC)/CCC2)OCC

InChI

InChI=1S/C30H36Cl2O5/c1-5-12-36-29-24(31)16-20(18-26(29)34-7-3)14-22-10-9-11-23(28(22)33)15-21-17-25(32)30(37-13-6-2)27(19-21)35-8-4/h14-19H,5-13H2,1-4H3/b22-14+,23-15+