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

Systemtic Name: 4-chloranyl-N-[(2S)-1-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S)-2-(3-chloro-4-fluoro-anilino)-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-1-(3-chloro-4-fluoroanilino)-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-1-(3-chloro-4-fluoroanilino)-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S)-2-(3-chloro-4-fluoro-anilino)-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C16H12Cl2FN3O4 MolecularWeight: 400.188583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12Cl2FN3O4/c1-8(15(23)21-10-3-5-13(19)12(18)7-10)20-16(24)9-2-4-11(17)14(6-9)22(25)26/h2-8H,1H3,(H,20,24)(H,21,23)/t8-/m0/s1