[2-[4-[(2S)-butan-2-yl]phenyl]-2-oxidanylidene-ethyl] 3,4,5-tris(chloranyl)pyridine-2-carboxylate

Systemtic Name: [2-[4-[(2S)-butan-2-yl]phenyl]-2-oxidanylidene-ethyl] 3,4,5-tris(chloranyl)pyridine-2-carboxylate Openeye Name: [2-[4-[(1S)-1-methylpropyl]phenyl]-2-oxo-ethyl] 3,4,5-trichloropyridine-2-carboxylate CAS Name: 3,4,5-trichloro-2-pyridinecarboxylic acid [2-[4-[(2S)-butan-2-yl]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[(2S)-butan-2-yl]phenyl]-2-oxoethyl] 3,4,5-trichloropyridine-2-carboxylate Traditional Name: 3,4,5-trichloropicolinic acid [2-keto-2-[4-[(1S)-1-methylpropyl]phenyl]ethyl] ester Formula: C18H16Cl3NO3 MolecularWeight: 400.68354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(=O)COC(=O)C2=NC=C(C(=C2Cl)Cl)Cl

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)C(=O)COC(=O)C2=NC=C(C(=C2Cl)Cl)Cl

InChI

InChI=1S/C18H16Cl3NO3/c1-3-10(2)11-4-6-12(7-5-11)14(23)9-25-18(24)17-16(21)15(20)13(19)8-22-17/h4-8,10H,3,9H2,1-2H3/t10-/m0/s1