pyridin-2-ylmethyl 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: pyridin-2-ylmethyl 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: 2-pyridylmethyl 4-chloro-3-morpholinosulfonyl-benzoate CAS Name: 4-chloro-3-(4-morpholinylsulfonyl)benzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 4-chloro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-chloro-3-morpholinosulfonyl-benzoic acid 2-pyridylmethyl ester Formula: C17H17ClN2O5S MolecularWeight: 396.84528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=CC=N3)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC=CC=N3)Cl

InChI

InChI=1S/C17H17ClN2O5S/c18-15-5-4-13(17(21)25-12-14-3-1-2-6-19-14)11-16(15)26(22,23)20-7-9-24-10-8-20/h1-6,11H,7-10,12H2