ethyl 3-methyl-4-[2-oxidanyl-3-(pyridin-3-ylmethylamino)propoxy]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-methyl-4-[2-oxidanyl-3-(pyridin-3-ylmethylamino)propoxy]-1-benzofuran-2-carboxylate Openeye Name: ethyl 4-[2-hydroxy-3-(3-pyridylmethylamino)propoxy]-3-methyl-benzofuran-2-carboxylate CAS Name: 4-[2-hydroxy-3-(3-pyridinylmethylamino)propoxy]-3-methyl-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-hydroxy-3-(pyridin-3-ylmethylamino)propoxy]-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 4-[2-hydroxy-3-(3-pyridylmethylamino)propoxy]-3-methyl-coumarilic acid ethyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC=C2OCC(CNCC3=CN=CC=C3)O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC=C2OCC(CNCC3=CN=CC=C3)O)C

InChI

InChI=1S/C21H24N2O5/c1-3-26-21(25)20-14(2)19-17(7-4-8-18(19)28-20)27-13-16(24)12-23-11-15-6-5-9-22-10-15/h4-10,16,23-24H,3,11-13H2,1-2H3