4-butoxy-3-chloranyl-5-[(2Z,4E)-5-(2,6-dimethyl-3-oxidanylidene-cyclohexyl)-3-methyl-penta-2,4-dienyl]-2-methyl-6-oxidanyl-benzaldehyde

Systemtic Name: 4-butoxy-3-chloranyl-5-[(2Z,4E)-5-(2,6-dimethyl-3-oxidanylidene-cyclohexyl)-3-methyl-penta-2,4-dienyl]-2-methyl-6-oxidanyl-benzaldehyde Openeye Name: 4-butoxy-5-chloro-3-[(2Z,4E)-5-(2,6-dimethyl-3-oxo-cyclohexyl)-3-methyl-penta-2,4-dienyl]-2-hydroxy-6-methyl-benzaldehyde CAS Name: 4-butoxy-5-chloro-3-[(2Z,4E)-5-(2,6-dimethyl-3-oxocyclohexyl)-3-methylpenta-2,4-dienyl]-2-hydroxy-6-methylbenzaldehyde IUPAC Name: 4-butoxy-5-chloro-3-[(2Z,4E)-5-(2,6-dimethyl-3-oxocyclohexyl)-3-methylpenta-2,4-dienyl]-2-hydroxy-6-methylbenzaldehyde Traditional Name: 4-butoxy-5-chloro-2-hydroxy-3-[(2Z,4E)-5-(3-keto-2,6-dimethyl-cyclohexyl)-3-methyl-penta-2,4-dienyl]-6-methyl-benzaldehyde Formula: C26H35ClO4 MolecularWeight: 447.0067

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C(C(=C1CC=C(C)C=CC2C(CCC(=O)C2C)C)O)C=O)C)Cl

Isomeric SMILES

CCCCOC1=C(C(=C(C(=C1C/C=C(/C)\C=C\C2C(CCC(=O)C2C)C)O)C=O)C)Cl

InChI

InChI=1S/C26H35ClO4/c1-6-7-14-31-26-21(25(30)22(15-28)19(5)24(26)27)12-9-16(2)8-11-20-17(3)10-13-23(29)18(20)4/h8-9,11,15,17-18,20,30H,6-7,10,12-14H2,1-5H3/b11-8+,16-9-