4-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]benzoic acid

Systemtic Name: 4-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]benzoic acid Openeye Name: 4-[1-(2,3-dihydrobenzofuran-5-yl)ethylamino]benzoic acid CAS Name: 4-[1-(2,3-dihydrobenzofuran-5-yl)ethylamino]benzoic acid IUPAC Name: 4-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]benzoic acid Traditional Name: 4-(1-coumaran-5-ylethylamino)benzoic acid Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCC2)NC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCC2)NC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H17NO3/c1-11(13-4-7-16-14(10-13)8-9-21-16)18-15-5-2-12(3-6-15)17(19)20/h2-7,10-11,18H,8-9H2,1H3,(H,19,20)