N-[[4-(methylcarbamoyl)phenyl]methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[[4-(methylcarbamoyl)phenyl]methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[[4-(methylcarbamoyl)phenyl]methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[[4-(methylcarbamoyl)phenyl]methyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[[4-(methylcarbamoyl)phenyl]methyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[4-(methylcarbamoyl)benzyl]-3-nitro-4-pyrrolidino-benzamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O4/c1-21-19(25)15-6-4-14(5-7-15)13-22-20(26)16-8-9-17(18(12-16)24(27)28)23-10-2-3-11-23/h4-9,12H,2-3,10-11,13H2,1H3,(H,21,25)(H,22,26)