4-tert-butyl-N-[[4-[(2-fluoranyl-5-nitro-phenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]benzamide

Systemtic Name: 4-tert-butyl-N-[[4-[(2-fluoranyl-5-nitro-phenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]benzamide Openeye Name: 4-tert-butyl-N-[[3-(2-fluoro-5-nitro-anilino)-1-methyl-3-oxo-propylidene]amino]benzamide CAS Name: 4-tert-butyl-N-[[4-(2-fluoro-5-nitroanilino)-4-oxobutan-2-ylidene]amino]benzamide IUPAC Name: 4-tert-butyl-N-[[4-(2-fluoro-5-nitroanilino)-4-oxobutan-2-ylidene]amino]benzamide Traditional Name: 4-tert-butyl-N-[[3-(2-fluoro-5-nitro-anilino)-3-keto-1-methyl-propylidene]amino]benzamide Formula: C21H23FN4O4 MolecularWeight: 414.430123

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23FN4O4/c1-13(11-19(27)23-18-12-16(26(29)30)9-10-17(18)22)24-25-20(28)14-5-7-15(8-6-14)21(2,3)4/h5-10,12H,11H2,1-4H3,(H,23,27)(H,25,28)