3-methyl-2-nitro-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)benzamide

Systemtic Name: 3-methyl-2-nitro-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)benzamide Openeye Name: N-[2-isopropoxy-5-(1-piperidylsulfonyl)phenyl]-3-methyl-2-nitro-benzamide CAS Name: 3-methyl-2-nitro-N-[5-(1-piperidinylsulfonyl)-2-propan-2-yloxyphenyl]benzamide IUPAC Name: 3-methyl-2-nitro-N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxyphenyl)benzamide Traditional Name: N-(2-isopropoxy-5-piperidinosulfonyl-phenyl)-3-methyl-2-nitro-benzamide Formula: C22H27N3O6S MolecularWeight: 461.53128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC(C)C

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)OC(C)C

InChI

InChI=1S/C22H27N3O6S/c1-15(2)31-20-11-10-17(32(29,30)24-12-5-4-6-13-24)14-19(20)23-22(26)18-9-7-8-16(3)21(18)25(27)28/h7-11,14-15H,4-6,12-13H2,1-3H3,(H,23,26)