1-[(2-nitrophenyl)methylsulfonyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-[(2-nitrophenyl)methylsulfonyl]pyrrolidine-2-carboxamide Openeye Name: 1-[(2-nitrophenyl)methylsulfonyl]pyrrolidine-2-carboxamide CAS Name: 1-[(2-nitrophenyl)methylsulfonyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-[(2-nitrophenyl)methylsulfonyl]pyrrolidine-2-carboxamide Traditional Name: 1-(2-nitrobenzyl)sulfonylpyrrolidine-2-carboxamide Formula: C12H15N3O5S MolecularWeight: 313.3296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C12H15N3O5S/c13-12(16)11-6-3-7-14(11)21(19,20)8-9-4-1-2-5-10(9)15(17)18/h1-2,4-5,11H,3,6-8H2,(H2,13,16)