N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide

Systemtic Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide Openeye Name: N-[1-(4-isobutylphenyl)ethyl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetamide CAS Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide IUPAC Name: N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)acetamide Traditional Name: N-[1-(4-isobutylphenyl)ethyl]-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)acetamide Formula: C24H31N3O6S MolecularWeight: 489.58444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C24H31N3O6S/c1-17(2)14-19-6-8-20(9-7-19)18(3)25-24(28)16-33-23-11-10-21(15-22(23)27(29)30)34(31,32)26-12-4-5-13-26/h6-11,15,17-18H,4-5,12-14,16H2,1-3H3,(H,25,28)