(4-cyanophenyl)methyl 3-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: (4-cyanophenyl)methyl 3-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (4-cyanophenyl)methyl 3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]propanoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(tosylamino)propionic acid (4-cyanobenzyl) ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H18N2O4S/c1-14-2-8-17(9-3-14)25(22,23)20-11-10-18(21)24-13-16-6-4-15(12-19)5-7-16/h2-9,20H,10-11,13H2,1H3