3-azanyl-5-[2-(5-fluoranyl-2-methoxy-phenyl)cyclopenten-1-yl]benzoic acid

Systemtic Name: 3-azanyl-5-[2-(5-fluoranyl-2-methoxy-phenyl)cyclopenten-1-yl]benzoic acid Openeye Name: 3-amino-5-[2-(5-fluoro-2-methoxy-phenyl)cyclopenten-1-yl]benzoic acid CAS Name: 3-amino-5-[2-(5-fluoro-2-methoxyphenyl)-1-cyclopentenyl]benzoic acid IUPAC Name: 3-amino-5-[2-(5-fluoro-2-methoxyphenyl)cyclopenten-1-yl]benzoic acid Traditional Name: 3-amino-5-[2-(5-fluoro-2-methoxy-phenyl)cyclopenten-1-yl]benzoic acid Formula: C19H18FNO3 MolecularWeight: 327.349523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C2=C(CCC2)C3=CC(=CC(=C3)N)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)F)C2=C(CCC2)C3=CC(=CC(=C3)N)C(=O)O

InChI

InChI=1S/C19H18FNO3/c1-24-18-6-5-13(20)10-17(18)16-4-2-3-15(16)11-7-12(19(22)23)9-14(21)8-11/h5-10H,2-4,21H2,1H3,(H,22,23)