4-(1-benzofuran-2-ylmethylamino)-3-methyl-benzoic acid

Systemtic Name: 4-(1-benzofuran-2-ylmethylamino)-3-methyl-benzoic acid Openeye Name: 4-(benzofuran-2-ylmethylamino)-3-methyl-benzoic acid CAS Name: 4-(2-benzofuranylmethylamino)-3-methylbenzoic acid IUPAC Name: 4-(1-benzofuran-2-ylmethylamino)-3-methylbenzoic acid Traditional Name: 4-(benzofuran-2-ylmethylamino)-3-methyl-benzoic acid Formula: C17H15NO3 MolecularWeight: 281.3059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NCC2=CC3=CC=CC=C3O2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NCC2=CC3=CC=CC=C3O2

InChI

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