methyl 5-morpholin-4-ylsulfonyl-6-(2-phenylmorpholin-4-yl)pyridine-3-carboxylate

Systemtic Name: methyl 5-morpholin-4-ylsulfonyl-6-(2-phenylmorpholin-4-yl)pyridine-3-carboxylate Openeye Name: methyl 5-morpholinosulfonyl-6-(2-phenylmorpholin-4-yl)pyridine-3-carboxylate CAS Name: 5-(4-morpholinylsulfonyl)-6-(2-phenyl-4-morpholinyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-morpholin-4-ylsulfonyl-6-(2-phenylmorpholin-4-yl)pyridine-3-carboxylate Traditional Name: 5-morpholinosulfonyl-6-(2-phenylmorpholino)nicotinic acid methyl ester Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(N=C1)N2CCOC(C2)C3=CC=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC(=O)C1=CC(=C(N=C1)N2CCOC(C2)C3=CC=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H25N3O6S/c1-28-21(25)17-13-19(31(26,27)24-8-10-29-11-9-24)20(22-14-17)23-7-12-30-18(15-23)16-5-3-2-4-6-16/h2-6,13-14,18H,7-12,15H2,1H3