(4-piperidin-1-ylcarbothioylphenyl) 2,4-bis(chloranyl)benzoate

Systemtic Name: (4-piperidin-1-ylcarbothioylphenyl) 2,4-bis(chloranyl)benzoate Openeye Name: [4-(piperidine-1-carbothioyl)phenyl] 2,4-dichlorobenzoate CAS Name: 2,4-dichlorobenzoic acid [4-[1-piperidinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [4-(piperidine-1-carbothioyl)phenyl] 2,4-dichlorobenzoate Traditional Name: 2,4-dichlorobenzoic acid [4-(piperidine-1-carbothioyl)phenyl] ester Formula: C19H17Cl2NO2S MolecularWeight: 394.31478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=S)C2=CC=C(C=C2)OC(=O)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCN(CC1)C(=S)C2=CC=C(C=C2)OC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H17Cl2NO2S/c20-14-6-9-16(17(21)12-14)19(23)24-15-7-4-13(5-8-15)18(25)22-10-2-1-3-11-22/h4-9,12H,1-3,10-11H2