4-[[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]methyl]-3-nitro-benzamide

Systemtic Name: 4-[[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]methyl]-3-nitro-benzamide Openeye Name: 4-[[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]methyl]-3-nitro-benzamide CAS Name: 4-[[2-(1-methyl-2-pyrrolyl)-1-pyrrolidinyl]methyl]-3-nitrobenzamide IUPAC Name: 4-[[2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]methyl]-3-nitrobenzamide Traditional Name: 4-[[2-(1-methylpyrrol-2-yl)pyrrolidino]methyl]-3-nitro-benzamide Formula: C17H20N4O3 MolecularWeight: 328.3657

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCN2CC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1C2CCCN2CC3=C(C=C(C=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O3/c1-19-8-2-4-14(19)15-5-3-9-20(15)11-13-7-6-12(17(18)22)10-16(13)21(23)24/h2,4,6-8,10,15H,3,5,9,11H2,1H3,(H2,18,22)