2-[6-[2-[(4-methoxycarbonylphenyl)-methyl-amino]ethoxy]-2,3-dihydro-1-benzofuran-3-yl]ethanoic acid

Systemtic Name: 2-[6-[2-[(4-methoxycarbonylphenyl)-methyl-amino]ethoxy]-2,3-dihydro-1-benzofuran-3-yl]ethanoic acid Openeye Name: 2-[6-[2-(4-methoxycarbonyl-N-methyl-anilino)ethoxy]-2,3-dihydrobenzofuran-3-yl]acetic acid CAS Name: 2-[6-[2-(4-methoxycarbonyl-N-methylanilino)ethoxy]-2,3-dihydrobenzofuran-3-yl]acetic acid IUPAC Name: 2-[6-[2-(4-methoxycarbonyl-N-methylanilino)ethoxy]-2,3-dihydro-1-benzofuran-3-yl]acetic acid Traditional Name: 2-[6-[2-(4-carbomethoxy-N-methyl-anilino)ethoxy]coumaran-3-yl]acetic acid Formula: C21H23NO6 MolecularWeight: 385.41042

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC2=C(C=C1)C(CO2)CC(=O)O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CN(CCOC1=CC2=C(C=C1)C(CO2)CC(=O)O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H23NO6/c1-22(16-5-3-14(4-6-16)21(25)26-2)9-10-27-17-7-8-18-15(11-20(23)24)13-28-19(18)12-17/h3-8,12,15H,9-11,13H2,1-2H3,(H,23,24)