3-chloranyl-5-[(E)-3,7-dimethyloct-1-enyl]-2-methyl-4,6-bis(oxidanyl)benzaldehyde

Systemtic Name: 3-chloranyl-5-[(E)-3,7-dimethyloct-1-enyl]-2-methyl-4,6-bis(oxidanyl)benzaldehyde Openeye Name: 5-chloro-3-[(E)-3,7-dimethyloct-1-enyl]-2,4-dihydroxy-6-methyl-benzaldehyde CAS Name: 5-chloro-3-[(E)-3,7-dimethyloct-1-enyl]-2,4-dihydroxy-6-methylbenzaldehyde IUPAC Name: 5-chloro-3-[(E)-3,7-dimethyloct-1-enyl]-2,4-dihydroxy-6-methylbenzaldehyde Traditional Name: 5-chloro-3-[(E)-3,7-dimethyloct-1-enyl]-2,4-dihydroxy-6-methyl-benzaldehyde Formula: C18H25ClO3 MolecularWeight: 324.8423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1Cl)O)C=CC(C)CCCC(C)C)O)C=O

Isomeric SMILES

CC1=C(C(=C(C(=C1Cl)O)/C=C/C(C)CCCC(C)C)O)C=O

InChI

InChI=1S/C18H25ClO3/c1-11(2)6-5-7-12(3)8-9-14-17(21)15(10-20)13(4)16(19)18(14)22/h8-12,21-22H,5-7H2,1-4H3/b9-8+