5-[(2-fluorophenyl)carbonylamino]-2-(3-oxidanylidenepiperazin-1-yl)benzoic acid

Systemtic Name: 5-[(2-fluorophenyl)carbonylamino]-2-(3-oxidanylidenepiperazin-1-yl)benzoic acid Openeye Name: 5-[(2-fluorobenzoyl)amino]-2-(3-oxopiperazin-1-yl)benzoic acid CAS Name: 5-[[(2-fluorophenyl)-oxomethyl]amino]-2-(3-oxo-1-piperazinyl)benzoic acid IUPAC Name: 5-[(2-fluorobenzoyl)amino]-2-(3-oxopiperazin-1-yl)benzoic acid Traditional Name: 5-[(2-fluorobenzoyl)amino]-2-(3-ketopiperazino)benzoic acid Formula: C18H16FN3O4 MolecularWeight: 357.335743

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3F)C(=O)O

Isomeric SMILES

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3F)C(=O)O

InChI

InChI=1S/C18H16FN3O4/c19-14-4-2-1-3-12(14)17(24)21-11-5-6-15(13(9-11)18(25)26)22-8-7-20-16(23)10-22/h1-6,9H,7-8,10H2,(H,20,23)(H,21,24)(H,25,26)