(4-nitrophenyl)methyl 3-[(2-chlorophenyl)sulfonylamino]propanoate

Systemtic Name: (4-nitrophenyl)methyl 3-[(2-chlorophenyl)sulfonylamino]propanoate Openeye Name: (4-nitrophenyl)methyl 3-[(2-chlorophenyl)sulfonylamino]propanoate CAS Name: 3-[(2-chlorophenyl)sulfonylamino]propanoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 3-[(2-chlorophenyl)sulfonylamino]propanoate Traditional Name: 3-[(2-chlorophenyl)sulfonylamino]propionic acid (4-nitrobenzyl) ester Formula: C16H15ClN2O6S MolecularWeight: 398.8181

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClN2O6S/c17-14-3-1-2-4-15(14)26(23,24)18-10-9-16(20)25-11-12-5-7-13(8-6-12)19(21)22/h1-8,18H,9-11H2