(3S)-3-(4-ethylphenyl)-3-thiophen-2-yl-propanoate

Systemtic Name: (3S)-3-(4-ethylphenyl)-3-thiophen-2-yl-propanoate Openeye Name: (3S)-3-(4-ethylphenyl)-3-(2-thienyl)propanoate CAS Name: (3S)-3-(4-ethylphenyl)-3-thiophen-2-ylpropanoate IUPAC Name: (3S)-3-(4-ethylphenyl)-3-thiophen-2-ylpropanoate Traditional Name: (3S)-3-(4-ethylphenyl)-3-(2-thienyl)propionate Formula: C15H15O2S- MolecularWeight: 259.3434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CC(=O)[O-])C2=CC=CS2

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CC(=O)[O-])C2=CC=CS2

InChI

InChI=1S/C15H16O2S/c1-2-11-5-7-12(8-6-11)13(10-15(16)17)14-4-3-9-18-14/h3-9,13H,2,10H2,1H3,(H,16,17)/p-1/t13-/m0/s1