2-bromanyl-2-(4,5-dihydro-1H-imidazol-2-yl)-4,6-dimethyl-3H-1,4-benzoxazine; ethanedioic acid

Systemtic Name: 2-bromanyl-2-(4,5-dihydro-1H-imidazol-2-yl)-4,6-dimethyl-3H-1,4-benzoxazine; ethanedioic acid Openeye Name: 2-bromo-2-(4,5-dihydro-1H-imidazol-2-yl)-4,6-dimethyl-3H-1,4-benzoxazine; oxalic acid CAS Name: 2-bromo-2-(4,5-dihydro-1H-imidazol-2-yl)-4,6-dimethyl-3H-1,4-benzoxazine; oxalic acid IUPAC Name: 2-bromo-2-(4,5-dihydro-1H-imidazol-2-yl)-4,6-dimethyl-3H-1,4-benzoxazine; oxalic acid Traditional Name: 2-bromo-2-(2-imidazolin-2-yl)-4,6-dimethyl-3H-1,4-benzoxazine; oxalic acid Formula: C15H18BrN3O5 MolecularWeight: 400.22452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(CN2C)(C3=NCCN3)Br.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC2=C(C=C1)OC(CN2C)(C3=NCCN3)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H16BrN3O.C2H2O4/c1-9-3-4-11-10(7-9)17(2)8-13(14,18-11)12-15-5-6-16-12;3-1(4)2(5)6/h3-4,7H,5-6,8H2,1-2H3,(H,15,16);(H,3,4)(H,5,6)