ethyl 2,2-bis(fluoranyl)-3-(4-methoxyphenyl)-3-phenoxycarbothioyloxy-propanoate

Systemtic Name: ethyl 2,2-bis(fluoranyl)-3-(4-methoxyphenyl)-3-phenoxycarbothioyloxy-propanoate Openeye Name: ethyl 2,2-difluoro-3-(4-methoxyphenyl)-3-phenoxycarbothioyloxy-propanoate CAS Name: 2,2-difluoro-3-(4-methoxyphenyl)-3-[phenoxy(sulfanylidene)methoxy]propanoic acid ethyl ester IUPAC Name: ethyl 2,2-difluoro-3-(4-methoxyphenyl)-3-phenoxycarbothioyloxypropanoate Traditional Name: 2,2-difluoro-3-(4-methoxyphenyl)-3-phenoxycarbothioyloxy-propionic acid ethyl ester Formula: C19H18F2O5S MolecularWeight: 396.405026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)OC)OC(=S)OC2=CC=CC=C2)(F)F

Isomeric SMILES

CCOC(=O)C(C(C1=CC=C(C=C1)OC)OC(=S)OC2=CC=CC=C2)(F)F

InChI

InChI=1S/C19H18F2O5S/c1-3-24-17(22)19(20,21)16(13-9-11-14(23-2)12-10-13)26-18(27)25-15-7-5-4-6-8-15/h4-12,16H,3H2,1-2H3