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

Systemtic Name: (4-nitrophenyl)methyl 3-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (4-nitrophenyl)methyl 3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(tosylamino)propionic acid (4-nitrobenzyl) ester Formula: C17H18N2O6S MolecularWeight: 378.39962

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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)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O6S/c1-13-2-8-16(9-3-13)26(23,24)18-11-10-17(20)25-12-14-4-6-15(7-5-14)19(21)22/h2-9,18H,10-12H2,1H3