1,3-benzoxazol-2-ylmethyl 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: 1,3-benzoxazol-2-ylmethyl 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: 1,3-benzoxazol-2-ylmethyl 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(4-acetamidophenyl)sulfonyl-methylamino]acetic acid 1,3-benzoxazol-2-ylmethyl ester IUPAC Name: 1,3-benzoxazol-2-ylmethyl 2-[(4-acetamidophenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-methyl-amino]acetic acid 1,3-benzoxazol-2-ylmethyl ester Formula: C19H19N3O6S MolecularWeight: 417.43566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OCC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)OCC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C19H19N3O6S/c1-13(23)20-14-7-9-15(10-8-14)29(25,26)22(2)11-19(24)27-12-18-21-16-5-3-4-6-17(16)28-18/h3-10H,11-12H2,1-2H3,(H,20,23)