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

Systemtic Name: (2S)-3-(5-bromanyl-2,3-dimethoxy-phenyl)-2-(4-methoxyphenyl)propanoic acid Openeye Name: (2S)-3-(5-bromo-2,3-dimethoxy-phenyl)-2-(4-methoxyphenyl)propanoic acid CAS Name: (2S)-3-(5-bromo-2,3-dimethoxyphenyl)-2-(4-methoxyphenyl)propanoic acid IUPAC Name: (2S)-3-(5-bromo-2,3-dimethoxyphenyl)-2-(4-methoxyphenyl)propanoic acid Traditional Name: (2S)-3-(5-bromo-2,3-dimethoxy-phenyl)-2-(4-methoxyphenyl)propionic acid Formula: C18H19BrO5 MolecularWeight: 395.24446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC2=CC(=CC(=C2OC)OC)Br)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CC2=CC(=CC(=C2OC)OC)Br)C(=O)O

InChI

InChI=1S/C18H19BrO5/c1-22-14-6-4-11(5-7-14)15(18(20)21)9-12-8-13(19)10-16(23-2)17(12)24-3/h4-8,10,15H,9H2,1-3H3,(H,20,21)/t15-/m0/s1