N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-3-nitro-benzamide

Systemtic Name: N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-3-nitro-benzamide Openeye Name: N-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]-3-nitro-benzamide CAS Name: N-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-3-nitrobenzamide IUPAC Name: N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-3-nitrobenzamide Traditional Name: N-[4-(3,5-dimethylpiperidino)sulfonylphenyl]-3-nitro-benzamide Formula: C20H23N3O5S MolecularWeight: 417.47872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H23N3O5S/c1-14-10-15(2)13-22(12-14)29(27,28)19-8-6-17(7-9-19)21-20(24)16-4-3-5-18(11-16)23(25)26/h3-9,11,14-15H,10,12-13H2,1-2H3,(H,21,24)