3-[(3-methyl-2-pyridin-2-ylcarbonyl-1-benzofuran-4-yl)oxy]propyl-(pyridin-3-ylmethyl)carbamic acid

Systemtic Name: 3-[(3-methyl-2-pyridin-2-ylcarbonyl-1-benzofuran-4-yl)oxy]propyl-(pyridin-3-ylmethyl)carbamic acid Openeye Name: 3-[3-methyl-2-(pyridine-2-carbonyl)benzofuran-4-yl]oxypropyl-(3-pyridylmethyl)carbamic acid CAS Name: 3-[[3-methyl-2-[oxo(2-pyridinyl)methyl]-4-benzofuranyl]oxy]propyl-(3-pyridinylmethyl)carbamic acid IUPAC Name: 3-[[3-methyl-2-(pyridine-2-carbonyl)-1-benzofuran-4-yl]oxy]propyl-(pyridin-3-ylmethyl)carbamic acid Traditional Name: 3-(3-methyl-2-picolinoyl-benzofuran-4-yl)oxypropyl-(3-pyridylmethyl)carbamic acid Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=CC=C2)OCCCN(CC3=CN=CC=C3)C(=O)O)C(=O)C4=CC=CC=N4

Isomeric SMILES

CC1=C(OC2=C1C(=CC=C2)OCCCN(CC3=CN=CC=C3)C(=O)O)C(=O)C4=CC=CC=N4

InChI

InChI=1S/C25H23N3O5/c1-17-22-20(32-14-6-13-28(25(30)31)16-18-7-5-11-26-15-18)9-4-10-21(22)33-24(17)23(29)19-8-2-3-12-27-19/h2-5,7-12,15H,6,13-14,16H2,1H3,(H,30,31)