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

Systemtic Name: N-[4-(2-methylpropanoyl)phenyl]-3-nitro-benzamide Openeye Name: N-[4-(2-methylpropanoyl)phenyl]-3-nitro-benzamide CAS Name: N-[4-(2-methyl-1-oxopropyl)phenyl]-3-nitrobenzamide IUPAC Name: N-[4-(2-methylpropanoyl)phenyl]-3-nitrobenzamide Traditional Name: N-(4-isobutyrylphenyl)-3-nitro-benzamide Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O4/c1-11(2)16(20)12-6-8-14(9-7-12)18-17(21)13-4-3-5-15(10-13)19(22)23/h3-11H,1-2H3,(H,18,21)