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

Systemtic Name: N-[(2S)-1-[(4-fluoranyl-3-nitro-phenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-methyl-benzamide Openeye Name: N-[(1S)-1-[(4-fluoro-3-nitro-phenyl)carbamoyl]-2-methyl-propyl]-4-methyl-benzamide CAS Name: N-[(2S)-1-(4-fluoro-3-nitroanilino)-3-methyl-1-oxobutan-2-yl]-4-methylbenzamide IUPAC Name: N-[(2S)-1-(4-fluoro-3-nitroanilino)-3-methyl-1-oxobutan-2-yl]-4-methylbenzamide Traditional Name: N-[(1S)-1-[(4-fluoro-3-nitro-phenyl)carbamoyl]-2-methyl-propyl]-4-methyl-benzamide Formula: C19H20FN3O4 MolecularWeight: 373.378203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C19H20FN3O4/c1-11(2)17(22-18(24)13-6-4-12(3)5-7-13)19(25)21-14-8-9-15(20)16(10-14)23(26)27/h4-11,17H,1-3H3,(H,21,25)(H,22,24)/t17-/m0/s1