3-[1-(5-bromanylpyridin-3-yl)carbonylpiperidin-4-yl]-5-tert-butyl-1,3-benzoxazol-2-one

Systemtic Name: 3-[1-(5-bromanylpyridin-3-yl)carbonylpiperidin-4-yl]-5-tert-butyl-1,3-benzoxazol-2-one Openeye Name: 3-[1-(5-bromopyridine-3-carbonyl)-4-piperidyl]-5-tert-butyl-1,3-benzoxazol-2-one CAS Name: 3-[1-[(5-bromo-3-pyridinyl)-oxomethyl]-4-piperidinyl]-5-tert-butyl-1,3-benzoxazol-2-one IUPAC Name: 3-[1-(5-bromopyridine-3-carbonyl)piperidin-4-yl]-5-tert-butyl-1,3-benzoxazol-2-one Traditional Name: 3-[1-(5-bromonicotinoyl)-4-piperidyl]-5-tert-butyl-1,3-benzoxazol-2-one Formula: C22H24BrN3O3 MolecularWeight: 458.34826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC(=O)N2C3CCN(CC3)C(=O)C4=CC(=CN=C4)Br

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC(=O)N2C3CCN(CC3)C(=O)C4=CC(=CN=C4)Br

InChI

InChI=1S/C22H24BrN3O3/c1-22(2,3)15-4-5-19-18(11-15)26(21(28)29-19)17-6-8-25(9-7-17)20(27)14-10-16(23)13-24-12-14/h4-5,10-13,17H,6-9H2,1-3H3