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

Systemtic Name: N-[(2S)-1-[(4-fluoranyl-3-nitro-phenyl)amino]-1-oxidanylidene-propan-2-yl]-3-methyl-benzamide Openeye Name: N-[(1S)-2-(4-fluoro-3-nitro-anilino)-1-methyl-2-oxo-ethyl]-3-methyl-benzamide CAS Name: N-[(2S)-1-(4-fluoro-3-nitroanilino)-1-oxopropan-2-yl]-3-methylbenzamide IUPAC Name: N-[(2S)-1-(4-fluoro-3-nitroanilino)-1-oxopropan-2-yl]-3-methylbenzamide Traditional Name: N-[(1S)-2-(4-fluoro-3-nitro-anilino)-2-keto-1-methyl-ethyl]-3-methyl-benzamide Formula: C17H16FN3O4 MolecularWeight: 345.325043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16FN3O4/c1-10-4-3-5-12(8-10)17(23)19-11(2)16(22)20-13-6-7-14(18)15(9-13)21(24)25/h3-9,11H,1-2H3,(H,19,23)(H,20,22)/t11-/m0/s1