(3-morpholin-4-ylsulfonylphenyl)methyl 6-chloranylpyridine-3-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 6-chloranylpyridine-3-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 6-chloropyridine-3-carboxylate CAS Name: 6-chloro-3-pyridinecarboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 6-chloropyridine-3-carboxylate Traditional Name: 6-chloronicotinic acid (3-morpholinosulfonylbenzyl) ester Formula: C17H17ClN2O5S MolecularWeight: 396.84528

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)C3=CN=C(C=C3)Cl

InChI

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