(2S)-3-(3-bromanyl-4-propoxy-phenyl)-2-phenyl-propanoic acid

Systemtic Name: (2S)-3-(3-bromanyl-4-propoxy-phenyl)-2-phenyl-propanoic acid Openeye Name: (2S)-3-(3-bromo-4-propoxy-phenyl)-2-phenyl-propanoic acid CAS Name: (2S)-3-(3-bromo-4-propoxyphenyl)-2-phenylpropanoic acid IUPAC Name: (2S)-3-(3-bromo-4-propoxyphenyl)-2-phenylpropanoic acid Traditional Name: (2S)-3-(3-bromo-4-propoxy-phenyl)-2-phenyl-propionic acid Formula: C18H19BrO3 MolecularWeight: 363.24566

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CC(C2=CC=CC=C2)C(=O)O)Br

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C[C@@H](C2=CC=CC=C2)C(=O)O)Br

InChI

InChI=1S/C18H19BrO3/c1-2-10-22-17-9-8-13(12-16(17)19)11-15(18(20)21)14-6-4-3-5-7-14/h3-9,12,15H,2,10-11H2,1H3,(H,20,21)/t15-/m0/s1