N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-4-(methylamino)-3-nitro-benzamide Openeye Name: N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]-4-(methylamino)-3-nitro-benzamide CAS Name: N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-4-(methylamino)-3-nitrobenzamide Traditional Name: N-(4-methoxy-3-piperidinosulfonyl-phenyl)-4-(methylamino)-3-nitro-benzamide Formula: C20H24N4O6S MolecularWeight: 448.49276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O6S/c1-21-16-8-6-14(12-17(16)24(26)27)20(25)22-15-7-9-18(30-2)19(13-15)31(28,29)23-10-4-3-5-11-23/h6-9,12-13,21H,3-5,10-11H2,1-2H3,(H,22,25)