(E)-3-chloranyl-3-[4-(2-methylpropyl)phenyl]prop-2-enal

Systemtic Name: (E)-3-chloranyl-3-[4-(2-methylpropyl)phenyl]prop-2-enal Openeye Name: (E)-3-chloro-3-(4-isobutylphenyl)prop-2-enal CAS Name: (E)-3-chloro-3-[4-(2-methylpropyl)phenyl]-2-propenal IUPAC Name: (E)-3-chloro-3-[4-(2-methylpropyl)phenyl]prop-2-enal Traditional Name: (E)-3-chloro-3-(4-isobutylphenyl)acrolein Formula: C13H15ClO MolecularWeight: 222.7106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(=CC=O)Cl

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)/C(=C\C=O)/Cl

InChI

InChI=1S/C13H15ClO/c1-10(2)9-11-3-5-12(6-4-11)13(14)7-8-15/h3-8,10H,9H2,1-2H3/b13-7+