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

Systemtic Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-3-nitro-benzamide Openeye Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-3-nitro-benzamide CAS Name: N-[[4-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-3-nitrobenzamide IUPAC Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-3-nitrobenzamide Traditional Name: N-[4-(isobutyrylamino)benzyl]-3-nitro-benzamide Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O4/c1-12(2)17(22)20-15-8-6-13(7-9-15)11-19-18(23)14-4-3-5-16(10-14)21(24)25/h3-10,12H,11H2,1-2H3,(H,19,23)(H,20,22)