(4-but-2-ynoxyphenyl)sulfanyl 2-(4-methoxyphenyl)butanoate

Systemtic Name: (4-but-2-ynoxyphenyl)sulfanyl 2-(4-methoxyphenyl)butanoate Openeye Name: (4-but-2-ynoxyphenyl)sulfanyl 2-(4-methoxyphenyl)butanoate CAS Name: 2-(4-methoxyphenyl)butanoic acid [(4-but-2-ynoxyphenyl)thio] ester IUPAC Name: (4-but-2-ynoxyphenyl)sulfanyl 2-(4-methoxyphenyl)butanoate Traditional Name: 2-(4-methoxyphenyl)butyric acid [(4-but-2-ynoxyphenyl)thio] ester Formula: C21H22O4S MolecularWeight: 370.46198

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)OC)C(=O)OSC2=CC=C(C=C2)OCC#CC

Isomeric SMILES

CCC(C1=CC=C(C=C1)OC)C(=O)OSC2=CC=C(C=C2)OCC#CC

InChI

InChI=1S/C21H22O4S/c1-4-6-15-24-18-11-13-19(14-12-18)26-25-21(22)20(5-2)16-7-9-17(23-3)10-8-16/h7-14,20H,5,15H2,1-3H3