(2S)-2-(2,5-diethoxyphenyl)sulfanyl-2-phenyl-ethanoate

Systemtic Name: (2S)-2-(2,5-diethoxyphenyl)sulfanyl-2-phenyl-ethanoate Openeye Name: (2S)-2-(2,5-diethoxyphenyl)sulfanyl-2-phenyl-acetate CAS Name: (2S)-2-[(2,5-diethoxyphenyl)thio]-2-phenylacetate IUPAC Name: (2S)-2-(2,5-diethoxyphenyl)sulfanyl-2-phenylacetate Traditional Name: (2S)-2-[(2,5-diethoxyphenyl)thio]-2-phenyl-acetate Formula: C18H19O4S- MolecularWeight: 331.40606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)SC(C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)S[C@@H](C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C18H20O4S/c1-3-21-14-10-11-15(22-4-2)16(12-14)23-17(18(19)20)13-8-6-5-7-9-13/h5-12,17H,3-4H2,1-2H3,(H,19,20)/p-1/t17-/m0/s1