(phenylmethyl) 2-[(4-acetamido-3-chloranyl-phenyl)sulfonylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[(4-acetamido-3-chloranyl-phenyl)sulfonylamino]ethanoate Openeye Name: benzyl 2-[(4-acetamido-3-chloro-phenyl)sulfonylamino]acetate CAS Name: 2-[(4-acetamido-3-chlorophenyl)sulfonylamino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(4-acetamido-3-chlorophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-acetamido-3-chloro-phenyl)sulfonylamino]acetic acid benzyl ester Formula: C17H17ClN2O5S MolecularWeight: 396.84528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CC=CC=C2)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CC=CC=C2)Cl

InChI

InChI=1S/C17H17ClN2O5S/c1-12(21)20-16-8-7-14(9-15(16)18)26(23,24)19-10-17(22)25-11-13-5-3-2-4-6-13/h2-9,19H,10-11H2,1H3,(H,20,21)