(2R)-4-(5-bromanylpyridin-3-yl)carbonyl-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2R)-4-(5-bromanylpyridin-3-yl)carbonyl-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2R)-4-(5-bromopyridine-3-carbonyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2R)-4-[(5-bromo-3-pyridinyl)-oxomethyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2R)-4-(5-bromopyridine-3-carbonyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2R)-4-(5-bromonicotinoyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C18H18BrN3O3 MolecularWeight: 404.25782

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CN(C2=CC=CC=C2O1)C(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

CCCNC(=O)[C@H]1CN(C2=CC=CC=C2O1)C(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C18H18BrN3O3/c1-2-7-21-17(23)16-11-22(14-5-3-4-6-15(14)25-16)18(24)12-8-13(19)10-20-9-12/h3-6,8-10,16H,2,7,11H2,1H3,(H,21,23)/t16-/m1/s1