N-[3-[(4-bromanyl-2-fluoranyl-phenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[(4-bromanyl-2-fluoranyl-phenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(4-bromo-2-fluoro-anilino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-(4-bromo-2-fluoroanilino)-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(4-bromo-2-fluoroanilino)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-(4-bromo-2-fluoro-anilino)-3-keto-propyl]-4-nitro-benzamide Formula: C16H13BrFN3O4 MolecularWeight: 410.194523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCC(=O)NC2=C(C=C(C=C2)Br)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCC(=O)NC2=C(C=C(C=C2)Br)F)[N+](=O)[O-]

InChI

InChI=1S/C16H13BrFN3O4/c17-11-3-6-14(13(18)9-11)20-15(22)7-8-19-16(23)10-1-4-12(5-2-10)21(24)25/h1-6,9H,7-8H2,(H,19,23)(H,20,22)