3,4,5-trimethoxy-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-nitro-benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-nitro-benzamide Openeye Name: 3,4,5-trimethoxy-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-nitro-benzamide CAS Name: 3,4,5-trimethoxy-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-2-nitrobenzamide IUPAC Name: 3,4,5-trimethoxy-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-2-nitrobenzamide Traditional Name: N-[3-(isobutyrylamino)benzyl]-3,4,5-trimethoxy-2-nitro-benzamide Formula: C21H25N3O7 MolecularWeight: 431.4391

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC(=C(C(=C2[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC(=C(C(=C2[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C21H25N3O7/c1-12(2)20(25)23-14-8-6-7-13(9-14)11-22-21(26)15-10-16(29-3)18(30-4)19(31-5)17(15)24(27)28/h6-10,12H,11H2,1-5H3,(H,22,26)(H,23,25)