4-fluoranyl-N-[3-[[5-nitro-6-oxidanylidene-3-(phenylmethyl)cyclohexa-2,4-dien-1-ylidene]methylamino]phenyl]benzamide

Systemtic Name: 4-fluoranyl-N-[3-[[5-nitro-6-oxidanylidene-3-(phenylmethyl)cyclohexa-2,4-dien-1-ylidene]methylamino]phenyl]benzamide Openeye Name: N-[3-[(3-benzyl-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-fluoro-benzamide CAS Name: 4-fluoro-N-[3-[[5-nitro-6-oxo-3-(phenylmethyl)-1-cyclohexa-2,4-dienylidene]methylamino]phenyl]benzamide IUPAC Name: N-[3-[(3-benzyl-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-fluorobenzamide Traditional Name: N-[3-[(3-benzyl-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]-4-fluoro-benzamide Formula: C27H20FN3O4 MolecularWeight: 469.463803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=CNC3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)F)C(=O)C(=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=CNC3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)F)C(=O)C(=C2)[N+](=O)[O-]

InChI

InChI=1S/C27H20FN3O4/c28-22-11-9-20(10-12-22)27(33)30-24-8-4-7-23(16-24)29-17-21-14-19(13-18-5-2-1-3-6-18)15-25(26(21)32)31(34)35/h1-12,14-17,29H,13H2,(H,30,33)