ethyl (E)-3-[4-(4-bromanylphenoxy)phenyl]-7-chloranyl-hept-2-enoate

Systemtic Name: ethyl (E)-3-[4-(4-bromanylphenoxy)phenyl]-7-chloranyl-hept-2-enoate Openeye Name: ethyl (E)-3-[4-(4-bromophenoxy)phenyl]-7-chloro-hept-2-enoate CAS Name: (E)-3-[4-(4-bromophenoxy)phenyl]-7-chloro-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-(4-bromophenoxy)phenyl]-7-chlorohept-2-enoate Traditional Name: (E)-3-[4-(4-bromophenoxy)phenyl]-7-chloro-hept-2-enoic acid ethyl ester Formula: C21H22BrClO3 MolecularWeight: 437.75458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(CCCCCl)C1=CC=C(C=C1)OC2=CC=C(C=C2)Br

Isomeric SMILES

CCOC(=O)/C=C(\CCCCCl)/C1=CC=C(C=C1)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C21H22BrClO3/c1-2-25-21(24)15-17(5-3-4-14-23)16-6-10-19(11-7-16)26-20-12-8-18(22)9-13-20/h6-13,15H,2-5,14H2,1H3/b17-15+