(5S)-5-[(4-bromanyl-6,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carbohydrazide

Systemtic Name: (5S)-5-[(4-bromanyl-6,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carbohydrazide Openeye Name: (5S)-5-[(4-bromo-6,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydroisoxazole-3-carbohydrazide CAS Name: (5S)-5-[(4-bromo-6,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydroisoxazole-3-carbohydrazide IUPAC Name: (5S)-5-[(4-bromo-6,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carbohydrazide Traditional Name: (5S)-5-[(4-bromo-6,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-2-isoxazoline-3-carbohydrazide Formula: C14H16BrN3O6 MolecularWeight: 402.19734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1OC)OCO2)Br)CC3CC(=NO3)C(=O)NN

Isomeric SMILES

COC1=C(C(=C2C(=C1OC)OCO2)Br)C[C@H]3CC(=NO3)C(=O)NN

InChI

InChI=1S/C14H16BrN3O6/c1-20-10-7(3-6-4-8(18-24-6)14(19)17-16)9(15)11-13(12(10)21-2)23-5-22-11/h6H,3-5,16H2,1-2H3,(H,17,19)/t6-/m0/s1