3-nitro-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]benzamide

Systemtic Name: 3-nitro-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]benzamide Openeye Name: 3-nitro-N-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethyl]benzamide CAS Name: 3-nitro-N-[2-(1-thiophen-2-ylsulfonyl-2-piperidinyl)ethyl]benzamide IUPAC Name: 3-nitro-N-[2-(1-thiophen-2-ylsulfonylpiperidin-2-yl)ethyl]benzamide Traditional Name: 3-nitro-N-[2-[1-(2-thienylsulfonyl)-2-piperidyl]ethyl]benzamide Formula: C18H21N3O5S2 MolecularWeight: 423.50644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CCN(C(C1)CCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H21N3O5S2/c22-18(14-5-3-7-16(13-14)21(23)24)19-10-9-15-6-1-2-11-20(15)28(25,26)17-8-4-12-27-17/h3-5,7-8,12-13,15H,1-2,6,9-11H2,(H,19,22)