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

Systemtic Name: 3-[(2-bromanyl-3-methyl-1-benzofuran-4-yl)oxy]propyl-(pyridin-3-ylmethyl)carbamic acid Openeye Name: 3-(2-bromo-3-methyl-benzofuran-4-yl)oxypropyl-(3-pyridylmethyl)carbamic acid CAS Name: 3-[(2-bromo-3-methyl-4-benzofuranyl)oxy]propyl-(3-pyridinylmethyl)carbamic acid IUPAC Name: 3-[(2-bromo-3-methyl-1-benzofuran-4-yl)oxy]propyl-(pyridin-3-ylmethyl)carbamic acid Traditional Name: 3-(2-bromo-3-methyl-benzofuran-4-yl)oxypropyl-(3-pyridylmethyl)carbamic acid Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrN2O4/c1-13-17-15(6-2-7-16(17)26-18(13)20)25-10-4-9-22(19(23)24)12-14-5-3-8-21-11-14/h2-3,5-8,11H,4,9-10,12H2,1H3,(H,23,24)