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

Systemtic Name: N-[(2S)-1-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: N-[(1S)-2-(3-chloro-4-fluoro-anilino)-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[(2S)-1-(3-chloro-4-fluoroanilino)-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: N-[(2S)-1-(3-chloro-4-fluoroanilino)-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: N-[(1S)-2-(3-chloro-4-fluoro-anilino)-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C16H13ClFN3O4 MolecularWeight: 365.743523

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClFN3O4/c1-9(15(22)20-11-5-6-14(18)13(17)8-11)19-16(23)10-3-2-4-12(7-10)21(24)25/h2-9H,1H3,(H,19,23)(H,20,22)/t9-/m0/s1