(2S)-3-(2-phenethyloxyphenyl)-2-thiophen-2-yl-propanoic acid

Systemtic Name: (2S)-3-(2-phenethyloxyphenyl)-2-thiophen-2-yl-propanoic acid Openeye Name: (2S)-3-(2-phenethyloxyphenyl)-2-(2-thienyl)propanoic acid CAS Name: (2S)-3-(2-phenethyloxyphenyl)-2-thiophen-2-ylpropanoic acid IUPAC Name: (2S)-3-(2-phenethyloxyphenyl)-2-thiophen-2-ylpropanoic acid Traditional Name: (2S)-3-(2-phenethyloxyphenyl)-2-(2-thienyl)propionic acid Formula: C21H20O3S MolecularWeight: 352.4467

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=CC=CC=C2CC(C3=CC=CS3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=CC=CC=C2C[C@H](C3=CC=CS3)C(=O)O

InChI

InChI=1S/C21H20O3S/c22-21(23)18(20-11-6-14-25-20)15-17-9-4-5-10-19(17)24-13-12-16-7-2-1-3-8-16/h1-11,14,18H,12-13,15H2,(H,22,23)/t18-/m1/s1