(2S)-3-(5-chloranyl-2-pentoxy-phenyl)-2-(4-methoxyphenyl)propanoic acid

Systemtic Name: (2S)-3-(5-chloranyl-2-pentoxy-phenyl)-2-(4-methoxyphenyl)propanoic acid Openeye Name: (2S)-3-(5-chloro-2-pentoxy-phenyl)-2-(4-methoxyphenyl)propanoic acid CAS Name: (2S)-3-(5-chloro-2-pentoxyphenyl)-2-(4-methoxyphenyl)propanoic acid IUPAC Name: (2S)-3-(5-chloro-2-pentoxyphenyl)-2-(4-methoxyphenyl)propanoic acid Traditional Name: (2S)-3-(2-amoxy-5-chloro-phenyl)-2-(4-methoxyphenyl)propionic acid Formula: C21H25ClO4 MolecularWeight: 376.8738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)Cl)CC(C2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)Cl)C[C@@H](C2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C21H25ClO4/c1-3-4-5-12-26-20-11-8-17(22)13-16(20)14-19(21(23)24)15-6-9-18(25-2)10-7-15/h6-11,13,19H,3-5,12,14H2,1-2H3,(H,23,24)/t19-/m0/s1