[1-methyl-5-[2-[(phenylmethyl)sulfonylamino]ethyl]pyrrol-2-yl] ethanoate

Systemtic Name: [1-methyl-5-[2-[(phenylmethyl)sulfonylamino]ethyl]pyrrol-2-yl] ethanoate Openeye Name: [5-[2-(benzylsulfonylamino)ethyl]-1-methyl-pyrrol-2-yl] acetate CAS Name: acetic acid [1-methyl-5-[2-[(phenylmethyl)sulfonylamino]ethyl]-2-pyrrolyl] ester IUPAC Name: [5-[2-(benzylsulfonylamino)ethyl]-1-methylpyrrol-2-yl] acetate Traditional Name: acetic acid [5-[2-(benzylsulfonylamino)ethyl]-1-methyl-pyrrol-2-yl] ester Formula: C16H20N2O4S MolecularWeight: 336.406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(N1C)CCNS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(=O)OC1=CC=C(N1C)CCNS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C16H20N2O4S/c1-13(19)22-16-9-8-15(18(16)2)10-11-17-23(20,21)12-14-6-4-3-5-7-14/h3-9,17H,10-12H2,1-2H3