(2R)-3-(3-chloranyl-4-hexoxy-5-methoxy-phenyl)-2-thiophen-2-yl-propanoate

Systemtic Name: (2R)-3-(3-chloranyl-4-hexoxy-5-methoxy-phenyl)-2-thiophen-2-yl-propanoate Openeye Name: (2R)-3-(3-chloro-4-hexoxy-5-methoxy-phenyl)-2-(2-thienyl)propanoate CAS Name: (2R)-3-(3-chloro-4-hexoxy-5-methoxyphenyl)-2-thiophen-2-ylpropanoate IUPAC Name: (2R)-3-(3-chloro-4-hexoxy-5-methoxyphenyl)-2-thiophen-2-ylpropanoate Traditional Name: (2R)-3-(3-chloro-4-hexoxy-5-methoxy-phenyl)-2-(2-thienyl)propionate Formula: C20H24ClO4S- MolecularWeight: 395.92016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Cl)CC(C2=CC=CS2)C(=O)[O-])OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Cl)C[C@@H](C2=CC=CS2)C(=O)[O-])OC

InChI

InChI=1S/C20H25ClO4S/c1-3-4-5-6-9-25-19-16(21)12-14(13-17(19)24-2)11-15(20(22)23)18-8-7-10-26-18/h7-8,10,12-13,15H,3-6,9,11H2,1-2H3,(H,22,23)/p-1/t15-/m0/s1