O-[4-methoxy-2,3-bis(trifluoromethyl)phenyl] 4-propylbenzenecarbothioate

Systemtic Name: O-[4-methoxy-2,3-bis(trifluoromethyl)phenyl] 4-propylbenzenecarbothioate Openeye Name: O-[4-methoxy-2,3-bis(trifluoromethyl)phenyl] 4-propylbenzenecarbothioate CAS Name: 4-propylbenzenecarbothioic acid O-[4-methoxy-2,3-bis(trifluoromethyl)phenyl] ester IUPAC Name: O-[4-methoxy-2,3-bis(trifluoromethyl)phenyl] 4-propylbenzenecarbothioate Traditional Name: 4-propylthiobenzoic acid O-[4-methoxy-2,3-bis(trifluoromethyl)phenyl] ester Formula: C19H16F6O2S MolecularWeight: 422.384559

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=S)OC2=C(C(=C(C=C2)OC)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=S)OC2=C(C(=C(C=C2)OC)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C19H16F6O2S/c1-3-4-11-5-7-12(8-6-11)17(28)27-14-10-9-13(26-2)15(18(20,21)22)16(14)19(23,24)25/h5-10H,3-4H2,1-2H3