ethyl 2-[(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-(pyridin-2-ylmethyl)amino]ethanoate

Systemtic Name: ethyl 2-[(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-(pyridin-2-ylmethyl)amino]ethanoate Openeye Name: ethyl 2-[(3-chloro-4-fluoro-phenyl)sulfonyl-(2-pyridylmethyl)amino]acetate CAS Name: 2-[(3-chloro-4-fluorophenyl)sulfonyl-(2-pyridinylmethyl)amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3-chloro-4-fluorophenyl)sulfonyl-(pyridin-2-ylmethyl)amino]acetate Traditional Name: 2-[(3-chloro-4-fluoro-phenyl)sulfonyl-(2-pyridylmethyl)amino]acetic acid ethyl ester Formula: C16H16ClFN2O4S MolecularWeight: 386.825643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=CC=CC=N1)S(=O)(=O)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CCOC(=O)CN(CC1=CC=CC=N1)S(=O)(=O)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C16H16ClFN2O4S/c1-2-24-16(21)11-20(10-12-5-3-4-8-19-12)25(22,23)13-6-7-15(18)14(17)9-13/h3-9H,2,10-11H2,1H3