N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Openeye Name: N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide CAS Name: N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-1-(2-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-1-(2-nitrophenyl)piperidine-4-carboxamide Traditional Name: N-[2-[(4-methoxyphenyl)sulfonylamino]ethyl]-1-(2-nitrophenyl)isonipecotamide Formula: C21H26N4O6S MolecularWeight: 462.51934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O6S/c1-31-17-6-8-18(9-7-17)32(29,30)23-13-12-22-21(26)16-10-14-24(15-11-16)19-4-2-3-5-20(19)25(27)28/h2-9,16,23H,10-15H2,1H3,(H,22,26)