(3-cyanophenyl)methyl 2-[(4-acetamidophenyl)sulfonylamino]ethanoate

Systemtic Name: (3-cyanophenyl)methyl 2-[(4-acetamidophenyl)sulfonylamino]ethanoate Openeye Name: (3-cyanophenyl)methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate CAS Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid (3-cyanobenzyl) ester Formula: C18H17N3O5S MolecularWeight: 387.40968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O5S/c1-13(22)21-16-5-7-17(8-6-16)27(24,25)20-11-18(23)26-12-15-4-2-3-14(9-15)10-19/h2-9,20H,11-12H2,1H3,(H,21,22)