3,4-bis(chloranyl)benzaldehyde; pentanal

Systemtic Name: 3,4-bis(chloranyl)benzaldehyde; pentanal Openeye Name: 3,4-dichlorobenzaldehyde; pentanal CAS Name: 3,4-dichlorobenzaldehyde; pentanal IUPAC Name: 3,4-dichlorobenzaldehyde; pentanal Traditional Name: 3,4-dichlorobenzaldehyde; valeraldehyde Formula: C12H14Cl2O2 MolecularWeight: 261.14436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC=O.C1=CC(=C(C=C1C=O)Cl)Cl

Isomeric SMILES

CCCCC=O.C1=CC(=C(C=C1C=O)Cl)Cl

InChI

InChI=1S/C7H4Cl2O.C5H10O/c8-6-2-1-5(4-10)3-7(6)9;1-2-3-4-5-6/h1-4H;5H,2-4H2,1H3