N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)-3-nitro-benzamide

Systemtic Name: N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-phenyl)-3-nitro-benzamide Openeye Name: N-[5-morpholinosulfonyl-2-(1-piperidyl)phenyl]-3-nitro-benzamide CAS Name: N-[5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)phenyl]-3-nitrobenzamide IUPAC Name: N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)-3-nitrobenzamide Traditional Name: N-(5-morpholinosulfonyl-2-piperidino-phenyl)-3-nitro-benzamide Formula: C22H26N4O6S MolecularWeight: 474.53004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O6S/c27-22(17-5-4-6-18(15-17)26(28)29)23-20-16-19(33(30,31)25-11-13-32-14-12-25)7-8-21(20)24-9-2-1-3-10-24/h4-8,15-16H,1-3,9-14H2,(H,23,27)