N-(2-methoxy-5-nitro-phenyl)-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-(2-methoxy-5-nitrophenyl)-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-1-propylsulfonyl-nipecotamide Formula: C16H23N3O6S MolecularWeight: 385.43532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C16H23N3O6S/c1-3-9-26(23,24)18-8-4-5-12(11-18)16(20)17-14-10-13(19(21)22)6-7-15(14)25-2/h6-7,10,12H,3-5,8-9,11H2,1-2H3,(H,17,20)