ethyl 3-[3-[2-(piperidin-1-ylsulfonylamino)ethyl]-5-(pyridin-3-ylmethyl)phenyl]propanoate

Systemtic Name: ethyl 3-[3-[2-(piperidin-1-ylsulfonylamino)ethyl]-5-(pyridin-3-ylmethyl)phenyl]propanoate Openeye Name: ethyl 3-[3-[2-(1-piperidylsulfonylamino)ethyl]-5-(3-pyridylmethyl)phenyl]propanoate CAS Name: 3-[3-[2-(1-piperidinylsulfonylamino)ethyl]-5-(3-pyridinylmethyl)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[2-(piperidin-1-ylsulfonylamino)ethyl]-5-(pyridin-3-ylmethyl)phenyl]propanoate Traditional Name: 3-[3-[2-(piperidinosulfonylamino)ethyl]-5-(3-pyridylmethyl)phenyl]propionic acid ethyl ester Formula: C24H33N3O4S MolecularWeight: 459.60152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC(=CC(=C1)CC2=CN=CC=C2)CCNS(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)CCC1=CC(=CC(=C1)CC2=CN=CC=C2)CCNS(=O)(=O)N3CCCCC3

InChI

InChI=1S/C24H33N3O4S/c1-2-31-24(28)9-8-20-15-21(17-23(16-20)18-22-7-6-11-25-19-22)10-12-26-32(29,30)27-13-4-3-5-14-27/h6-7,11,15-17,19,26H,2-5,8-10,12-14,18H2,1H3