3-[5-[[(2-methoxyphenyl)methylazaniumyl]methyl]furan-2-yl]benzoate

Systemtic Name: 3-[5-[[(2-methoxyphenyl)methylazaniumyl]methyl]furan-2-yl]benzoate Openeye Name: 3-[5-[[(2-methoxyphenyl)methylammonio]methyl]-2-furyl]benzoate CAS Name: 3-[5-[[(2-methoxyphenyl)methylammonio]methyl]-2-furanyl]benzoate IUPAC Name: 3-[5-[[(2-methoxyphenyl)methylazaniumyl]methyl]furan-2-yl]benzoate Traditional Name: 3-[5-[(o-anisylammonio)methyl]-2-furyl]benzoate Formula: C20H19NO4 MolecularWeight: 337.36916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C[NH2+]CC2=CC=C(O2)C3=CC(=CC=C3)C(=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1C[NH2+]CC2=CC=C(O2)C3=CC(=CC=C3)C(=O)[O-]

InChI

InChI=1S/C20H19NO4/c1-24-18-8-3-2-5-16(18)12-21-13-17-9-10-19(25-17)14-6-4-7-15(11-14)20(22)23/h2-11,21H,12-13H2,1H3,(H,22,23)