ethyl (E)-4-[3-methoxy-2-(phenylmethyl)phenyl]but-2-enoate

Systemtic Name: ethyl (E)-4-[3-methoxy-2-(phenylmethyl)phenyl]but-2-enoate Openeye Name: ethyl (E)-4-(2-benzyl-3-methoxy-phenyl)but-2-enoate CAS Name: (E)-4-[3-methoxy-2-(phenylmethyl)phenyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-(2-benzyl-3-methoxyphenyl)but-2-enoate Traditional Name: (E)-4-(2-benzyl-3-methoxy-phenyl)but-2-enoic acid ethyl ester Formula: C20H22O3 MolecularWeight: 310.38688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCC1=C(C(=CC=C1)OC)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C=C/CC1=C(C(=CC=C1)OC)CC2=CC=CC=C2

InChI

InChI=1S/C20H22O3/c1-3-23-20(21)14-8-12-17-11-7-13-19(22-2)18(17)15-16-9-5-4-6-10-16/h4-11,13-14H,3,12,15H2,1-2H3/b14-8+