(2S)-3-(5-chloranyl-2-phenethyloxy-phenyl)-2-thiophen-2-yl-propanoic acid

Systemtic Name: (2S)-3-(5-chloranyl-2-phenethyloxy-phenyl)-2-thiophen-2-yl-propanoic acid Openeye Name: (2S)-3-(5-chloro-2-phenethyloxy-phenyl)-2-(2-thienyl)propanoic acid CAS Name: (2S)-3-(5-chloro-2-phenethyloxyphenyl)-2-thiophen-2-ylpropanoic acid IUPAC Name: (2S)-3-(5-chloro-2-phenethyloxyphenyl)-2-thiophen-2-ylpropanoic acid Traditional Name: (2S)-3-(5-chloro-2-phenethyloxy-phenyl)-2-(2-thienyl)propionic acid Formula: C21H19ClO3S MolecularWeight: 386.89176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Cl)CC(C3=CC=CS3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Cl)C[C@H](C3=CC=CS3)C(=O)O

InChI

InChI=1S/C21H19ClO3S/c22-17-8-9-19(25-11-10-15-5-2-1-3-6-15)16(13-17)14-18(21(23)24)20-7-4-12-26-20/h1-9,12-13,18H,10-11,14H2,(H,23,24)/t18-/m1/s1