ethyl 3-propan-2-yl-4-[3-(pyridin-3-ylmethylamino)propoxy]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-propan-2-yl-4-[3-(pyridin-3-ylmethylamino)propoxy]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-isopropyl-4-[3-(3-pyridylmethylamino)propoxy]benzofuran-2-carboxylate CAS Name: 3-propan-2-yl-4-[3-(3-pyridinylmethylamino)propoxy]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-propan-2-yl-4-[3-(pyridin-3-ylmethylamino)propoxy]-1-benzofuran-2-carboxylate Traditional Name: 3-isopropyl-4-[3-(3-pyridylmethylamino)propoxy]coumarilic acid ethyl ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC=C2OCCCNCC3=CN=CC=C3)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC=C2OCCCNCC3=CN=CC=C3)C(C)C

InChI

InChI=1S/C23H28N2O4/c1-4-27-23(26)22-20(16(2)3)21-18(9-5-10-19(21)29-22)28-13-7-12-25-15-17-8-6-11-24-14-17/h5-6,8-11,14,16,25H,4,7,12-13,15H2,1-3H3