5-nitro-2-piperidin-1-yl-N-(2,4,6-trimethylphenyl)benzamide

Systemtic Name: 5-nitro-2-piperidin-1-yl-N-(2,4,6-trimethylphenyl)benzamide Openeye Name: 5-nitro-2-(1-piperidyl)-N-(2,4,6-trimethylphenyl)benzamide CAS Name: 5-nitro-2-(1-piperidinyl)-N-(2,4,6-trimethylphenyl)benzamide IUPAC Name: 5-nitro-2-piperidin-1-yl-N-(2,4,6-trimethylphenyl)benzamide Traditional Name: N-mesityl-5-nitro-2-piperidino-benzamide Formula: C21H25N3O3 MolecularWeight: 367.4415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3)C

InChI

InChI=1S/C21H25N3O3/c1-14-11-15(2)20(16(3)12-14)22-21(25)18-13-17(24(26)27)7-8-19(18)23-9-5-4-6-10-23/h7-8,11-13H,4-6,9-10H2,1-3H3,(H,22,25)