4-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-[[3-ethoxy-4-(2-fluorobenzyl)oxy-benzyl]amino]-4-keto-butyric acid Formula: C20H22FNO5 MolecularWeight: 375.390783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNC(=O)CCC(=O)O)OCC2=CC=CC=C2F

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNC(=O)CCC(=O)O)OCC2=CC=CC=C2F

InChI

InChI=1S/C20H22FNO5/c1-2-26-18-11-14(12-22-19(23)9-10-20(24)25)7-8-17(18)27-13-15-5-3-4-6-16(15)21/h3-8,11H,2,9-10,12-13H2,1H3,(H,22,23)(H,24,25)