2-(4-but-2-ynoxyphenyl)sulfanyl-2-(4-methoxyphenyl)ethanoic acid

Systemtic Name: 2-(4-but-2-ynoxyphenyl)sulfanyl-2-(4-methoxyphenyl)ethanoic acid Openeye Name: 2-(4-but-2-ynoxyphenyl)sulfanyl-2-(4-methoxyphenyl)acetic acid CAS Name: 2-[(4-but-2-ynoxyphenyl)thio]-2-(4-methoxyphenyl)acetic acid IUPAC Name: 2-(4-but-2-ynoxyphenyl)sulfanyl-2-(4-methoxyphenyl)acetic acid Traditional Name: 2-[(4-but-2-ynoxyphenyl)thio]-2-(4-methoxyphenyl)acetic acid Formula: C19H18O4S MolecularWeight: 342.40882

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)SC(C2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)SC(C2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C19H18O4S/c1-3-4-13-23-16-9-11-17(12-10-16)24-18(19(20)21)14-5-7-15(22-2)8-6-14/h5-12,18H,13H2,1-2H3,(H,20,21)