1-[3-methyl-4-[3-(pyridin-3-ylmethylamino)propoxy]-1-benzofuran-2-yl]butan-1-one

Systemtic Name: 1-[3-methyl-4-[3-(pyridin-3-ylmethylamino)propoxy]-1-benzofuran-2-yl]butan-1-one Openeye Name: 1-[3-methyl-4-[3-(3-pyridylmethylamino)propoxy]benzofuran-2-yl]butan-1-one CAS Name: 1-[3-methyl-4-[3-(3-pyridinylmethylamino)propoxy]-2-benzofuranyl]-1-butanone IUPAC Name: 1-[3-methyl-4-[3-(pyridin-3-ylmethylamino)propoxy]-1-benzofuran-2-yl]butan-1-one Traditional Name: 1-[3-methyl-4-[3-(3-pyridylmethylamino)propoxy]benzofuran-2-yl]butan-1-one Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O3/c1-3-7-18(25)22-16(2)21-19(9-4-10-20(21)27-22)26-13-6-12-24-15-17-8-5-11-23-14-17/h4-5,8-11,14,24H,3,6-7,12-13,15H2,1-2H3