(2S)-3-(5-bromanyl-3-methoxy-2-propoxy-phenyl)-2-phenyl-propanoic acid

Systemtic Name: (2S)-3-(5-bromanyl-3-methoxy-2-propoxy-phenyl)-2-phenyl-propanoic acid Openeye Name: (2S)-3-(5-bromo-3-methoxy-2-propoxy-phenyl)-2-phenyl-propanoic acid CAS Name: (2S)-3-(5-bromo-3-methoxy-2-propoxyphenyl)-2-phenylpropanoic acid IUPAC Name: (2S)-3-(5-bromo-3-methoxy-2-propoxyphenyl)-2-phenylpropanoic acid Traditional Name: (2S)-3-(5-bromo-3-methoxy-2-propoxy-phenyl)-2-phenyl-propionic acid Formula: C19H21BrO4 MolecularWeight: 393.27164

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1CC(C2=CC=CC=C2)C(=O)O)Br)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1C[C@@H](C2=CC=CC=C2)C(=O)O)Br)OC

InChI

InChI=1S/C19H21BrO4/c1-3-9-24-18-14(10-15(20)12-17(18)23-2)11-16(19(21)22)13-7-5-4-6-8-13/h4-8,10,12,16H,3,9,11H2,1-2H3,(H,21,22)/t16-/m0/s1