N-[[2-(dimethylamino)pyridin-3-yl]methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[[2-(dimethylamino)-3-pyridinyl]methyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-3-nitro-4-pyrrolidino-benzamide Formula: C19H23N5O3 MolecularWeight: 369.41762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC=N1)CNC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=CC=N1)CNC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N5O3/c1-22(2)18-15(6-5-9-20-18)13-21-19(25)14-7-8-16(17(12-14)24(26)27)23-10-3-4-11-23/h5-9,12H,3-4,10-11,13H2,1-2H3,(H,21,25)