ethyl 5-(3-phenylpropylsulfonylcarbamoyl)pyridine-2-carboxylate

Systemtic Name: ethyl 5-(3-phenylpropylsulfonylcarbamoyl)pyridine-2-carboxylate Openeye Name: ethyl 5-(3-phenylpropylsulfonylcarbamoyl)pyridine-2-carboxylate CAS Name: 5-[oxo-(3-phenylpropylsulfonylamino)methyl]-2-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-phenylpropylsulfonylcarbamoyl)pyridine-2-carboxylate Traditional Name: 5-(3-phenylpropylsulfonylcarbamoyl)picolinic acid ethyl ester Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)CCCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=NC=C(C=C1)C(=O)NS(=O)(=O)CCCC2=CC=CC=C2

InChI

InChI=1S/C18H20N2O5S/c1-2-25-18(22)16-11-10-15(13-19-16)17(21)20-26(23,24)12-6-9-14-7-4-3-5-8-14/h3-5,7-8,10-11,13H,2,6,9,12H2,1H3,(H,20,21)