N-[(3S)-4-ethanoyl-5-methyl-2-oxidanylidene-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-nitro-benzamide

Systemtic Name: N-[(3S)-4-ethanoyl-5-methyl-2-oxidanylidene-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-nitro-benzamide Openeye Name: N-[(3S)-4-acetyl-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-nitro-benzamide CAS Name: N-[(3S)-4-acetyl-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-nitrobenzamide IUPAC Name: N-[(3S)-4-acetyl-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-nitrobenzamide Traditional Name: N-[(3S)-4-acetyl-2-keto-5-methyl-3-(trifluoromethyl)-2-pyrrolin-3-yl]-3-nitro-benzamide Formula: C15H12F3N3O5 MolecularWeight: 371.26809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=O)N1)(C(F)(F)F)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C([C@](C(=O)N1)(C(F)(F)F)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C15H12F3N3O5/c1-7-11(8(2)22)14(13(24)19-7,15(16,17)18)20-12(23)9-4-3-5-10(6-9)21(25)26/h3-6H,1-2H3,(H,19,24)(H,20,23)/t14-/m0/s1