methyl 2-[(4-acetamidophenyl)sulfonyl-(phenylmethyl)amino]ethanoate

Systemtic Name: methyl 2-[(4-acetamidophenyl)sulfonyl-(phenylmethyl)amino]ethanoate Openeye Name: methyl 2-[(4-acetamidophenyl)sulfonyl-benzyl-amino]acetate CAS Name: 2-[(4-acetamidophenyl)sulfonyl-(phenylmethyl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[(4-acetamidophenyl)sulfonyl-benzylamino]acetate Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-benzyl-amino]acetic acid methyl ester Formula: C18H20N2O5S MolecularWeight: 376.4268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)CC(=O)OC

InChI

InChI=1S/C18H20N2O5S/c1-14(21)19-16-8-10-17(11-9-16)26(23,24)20(13-18(22)25-2)12-15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3,(H,19,21)