ethyl 3-[3-[2-(methylsulfonylamino)ethyl]-5-(pyridin-3-ylmethyl)phenyl]propanoate

Systemtic Name: ethyl 3-[3-[2-(methylsulfonylamino)ethyl]-5-(pyridin-3-ylmethyl)phenyl]propanoate Openeye Name: ethyl 3-[3-[2-(methanesulfonamido)ethyl]-5-(3-pyridylmethyl)phenyl]propanoate CAS Name: 3-[3-[2-(methanesulfonamido)ethyl]-5-(3-pyridinylmethyl)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[2-(methanesulfonamido)ethyl]-5-(pyridin-3-ylmethyl)phenyl]propanoate Traditional Name: 3-[3-[2-(methanesulfonamido)ethyl]-5-(3-pyridylmethyl)phenyl]propionic acid ethyl ester Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC(=CC(=C1)CC2=CN=CC=C2)CCNS(=O)(=O)C

Isomeric SMILES

CCOC(=O)CCC1=CC(=CC(=C1)CC2=CN=CC=C2)CCNS(=O)(=O)C

InChI

InChI=1S/C20H26N2O4S/c1-3-26-20(23)7-6-16-11-17(8-10-22-27(2,24)25)13-19(12-16)14-18-5-4-9-21-15-18/h4-5,9,11-13,15,22H,3,6-8,10,14H2,1-2H3