(2S)-3-(3-bromanyl-4,5-diethoxy-phenyl)-2-phenyl-propanoic acid

Systemtic Name: (2S)-3-(3-bromanyl-4,5-diethoxy-phenyl)-2-phenyl-propanoic acid Openeye Name: (2S)-3-(3-bromo-4,5-diethoxy-phenyl)-2-phenyl-propanoic acid CAS Name: (2S)-3-(3-bromo-4,5-diethoxyphenyl)-2-phenylpropanoic acid IUPAC Name: (2S)-3-(3-bromo-4,5-diethoxyphenyl)-2-phenylpropanoic acid Traditional Name: (2S)-3-(3-bromo-4,5-diethoxy-phenyl)-2-phenyl-propionic acid Formula: C19H21BrO4 MolecularWeight: 393.27164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CC(C2=CC=CC=C2)C(=O)O)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[C@@H](C2=CC=CC=C2)C(=O)O)Br)OCC

InChI

InChI=1S/C19H21BrO4/c1-3-23-17-12-13(11-16(20)18(17)24-4-2)10-15(19(21)22)14-8-6-5-7-9-14/h5-9,11-12,15H,3-4,10H2,1-2H3,(H,21,22)/t15-/m0/s1