2-bromanyl-N-[(2S)-1-[(4-fluoranyl-3-nitro-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: 2-bromanyl-N-[(2S)-1-[(4-fluoranyl-3-nitro-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 2-bromo-N-[(1S)-1-[(4-fluoro-3-nitro-phenyl)carbamoyl]-2-methyl-propyl]benzamide CAS Name: 2-bromo-N-[(2S)-1-(4-fluoro-3-nitroanilino)-3-methyl-1-oxobutan-2-yl]benzamide IUPAC Name: 2-bromo-N-[(2S)-1-(4-fluoro-3-nitroanilino)-3-methyl-1-oxobutan-2-yl]benzamide Traditional Name: 2-bromo-N-[(1S)-1-[(4-fluoro-3-nitro-phenyl)carbamoyl]-2-methyl-propyl]benzamide Formula: C18H17BrFN3O4 MolecularWeight: 438.247683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-])NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC(=C(C=C1)F)[N+](=O)[O-])NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C18H17BrFN3O4/c1-10(2)16(22-17(24)12-5-3-4-6-13(12)19)18(25)21-11-7-8-14(20)15(9-11)23(26)27/h3-10,16H,1-2H3,(H,21,25)(H,22,24)/t16-/m0/s1