3-[[methyl(phenyl)amino]methyl]-1-benzofuran-2-carboxylate

Systemtic Name: 3-[[methyl(phenyl)amino]methyl]-1-benzofuran-2-carboxylate Openeye Name: 3-[(N-methylanilino)methyl]benzofuran-2-carboxylate CAS Name: 3-[(N-methylanilino)methyl]-2-benzofurancarboxylate IUPAC Name: 3-[(N-methylanilino)methyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[(N-methylanilino)methyl]coumarilate Formula: C17H14NO3- MolecularWeight: 280.29796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(OC2=CC=CC=C21)C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CN(CC1=C(OC2=CC=CC=C21)C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C17H15NO3/c1-18(12-7-3-2-4-8-12)11-14-13-9-5-6-10-15(13)21-16(14)17(19)20/h2-10H,11H2,1H3,(H,19,20)/p-1