pyridin-2-ylmethyl 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: pyridin-2-ylmethyl 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: 2-pyridylmethyl 2-chloro-5-morpholinosulfonyl-benzoate CAS Name: 2-chloro-5-(4-morpholinylsulfonyl)benzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 2-chloro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-chloro-5-morpholinosulfonyl-benzoic acid 2-pyridylmethyl ester Formula: C17H17ClN2O5S MolecularWeight: 396.84528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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