pyridin-2-ylmethyl 3-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: pyridin-2-ylmethyl 3-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: 2-pyridylmethyl 3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]propanoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 3-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(tosylamino)propionic acid 2-pyridylmethyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC=CC=N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC=CC=N2

InChI

InChI=1S/C16H18N2O4S/c1-13-5-7-15(8-6-13)23(20,21)18-11-9-16(19)22-12-14-4-2-3-10-17-14/h2-8,10,18H,9,11-12H2,1H3