2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylamino]-N,4-dimethyl-pentanamide

Systemtic Name: 2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylamino]-N,4-dimethyl-pentanamide Openeye Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-N,4-dimethyl-pentanamide CAS Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-N,4-dimethylpentanamide IUPAC Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-N,4-dimethylpentanamide Traditional Name: 2-[(6-bromo-1,3-benzodioxol-5-yl)methylamino]-N,4-dimethyl-valeramide Formula: C15H21BrN2O3 MolecularWeight: 357.24284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC)NCC1=CC2=C(C=C1Br)OCO2

Isomeric SMILES

CC(C)CC(C(=O)NC)NCC1=CC2=C(C=C1Br)OCO2

InChI

InChI=1S/C15H21BrN2O3/c1-9(2)4-12(15(19)17-3)18-7-10-5-13-14(6-11(10)16)21-8-20-13/h5-6,9,12,18H,4,7-8H2,1-3H3,(H,17,19)