2-[4-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]-3-fluoranyl-phenyl]cyclopropane-1-carboxylic acid

Systemtic Name: 2-[4-[[3-(diazanylmethylideneamino)phenyl]carbonylamino]-3-fluoranyl-phenyl]cyclopropane-1-carboxylic acid Openeye Name: 2-[3-fluoro-4-[[3-(hydrazinomethyleneamino)benzoyl]amino]phenyl]cyclopropanecarboxylic acid CAS Name: 2-[3-fluoro-4-[[[3-(hydrazinylmethylideneamino)phenyl]-oxomethyl]amino]phenyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-[3-fluoro-4-[[3-(hydrazinylmethylideneamino)benzoyl]amino]phenyl]cyclopropane-1-carboxylic acid Traditional Name: 2-[3-fluoro-4-[[3-(hydrazinomethyleneamino)benzoyl]amino]phenyl]cyclopropanecarboxylic acid Formula: C18H17FN4O3 MolecularWeight: 356.350983

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1C(=O)O)C2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)N=CNN)F

Isomeric SMILES

C1C(C1C(=O)O)C2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)N=CNN)F

InChI

InChI=1S/C18H17FN4O3/c19-15-7-10(13-8-14(13)18(25)26)4-5-16(15)23-17(24)11-2-1-3-12(6-11)21-9-22-20/h1-7,9,13-14H,8,20H2,(H,21,22)(H,23,24)(H,25,26)