4-bromanyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]-3-nitro-benzamide

Systemtic Name: 4-bromanyl-N-[3-(2,2-dimethylpropanoylamino)phenyl]-3-nitro-benzamide Openeye Name: 4-bromo-N-[3-(2,2-dimethylpropanoylamino)phenyl]-3-nitro-benzamide CAS Name: 4-bromo-N-[3-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]-3-nitrobenzamide IUPAC Name: 4-bromo-N-[3-(2,2-dimethylpropanoylamino)phenyl]-3-nitrobenzamide Traditional Name: 4-bromo-3-nitro-N-[3-(pivaloylamino)phenyl]benzamide Formula: C18H18BrN3O4 MolecularWeight: 420.25722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrN3O4/c1-18(2,3)17(24)21-13-6-4-5-12(10-13)20-16(23)11-7-8-14(19)15(9-11)22(25)26/h4-10H,1-3H3,(H,20,23)(H,21,24)