4-[[3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]methylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]phenyl]methylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[[3-[(2-chloro-6-fluoro-phenyl)methoxy]phenyl]methylamino]-4-oxo-butanoate CAS Name: 4-[[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylamino]-4-oxobutanoate IUPAC Name: 4-[[3-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methylamino]-4-oxobutanoate Traditional Name: 4-[[3-(2-chloro-6-fluoro-benzyl)oxybenzyl]amino]-4-keto-butyrate Formula: C18H16ClFNO4- MolecularWeight: 364.775343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC2=C(C=CC=C2Cl)F)CNC(=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OCC2=C(C=CC=C2Cl)F)CNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C18H17ClFNO4/c19-15-5-2-6-16(20)14(15)11-25-13-4-1-3-12(9-13)10-21-17(22)7-8-18(23)24/h1-6,9H,7-8,10-11H2,(H,21,22)(H,23,24)/p-1