4-tert-butyl-N-[3-[(4-fluoranyl-3-nitro-phenyl)amino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[(4-fluoranyl-3-nitro-phenyl)amino]-3-oxidanylidene-propyl]benzamide Openeye Name: 4-tert-butyl-N-[3-(4-fluoro-3-nitro-anilino)-3-oxo-propyl]benzamide CAS Name: 4-tert-butyl-N-[3-(4-fluoro-3-nitroanilino)-3-oxopropyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-(4-fluoro-3-nitroanilino)-3-oxopropyl]benzamide Traditional Name: 4-tert-butyl-N-[3-(4-fluoro-3-nitro-anilino)-3-keto-propyl]benzamide Formula: C20H22FN3O4 MolecularWeight: 387.404783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22FN3O4/c1-20(2,3)14-6-4-13(5-7-14)19(26)22-11-10-18(25)23-15-8-9-16(21)17(12-15)24(27)28/h4-9,12H,10-11H2,1-3H3,(H,22,26)(H,23,25)