2-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylamino]-N-ethyl-propanamide

Systemtic Name: 2-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylamino]-N-ethyl-propanamide Openeye Name: 2-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylamino]-N-ethyl-propanamide CAS Name: 2-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylamino]-N-ethylpropanamide IUPAC Name: 2-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylamino]-N-ethylpropanamide Traditional Name: 2-[(3-bromo-4-hydroxy-5-methoxy-benzyl)amino]-N-ethyl-propionamide Formula: C13H19BrN2O3 MolecularWeight: 331.20556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NCC1=CC(=C(C(=C1)Br)O)OC

Isomeric SMILES

CCNC(=O)C(C)NCC1=CC(=C(C(=C1)Br)O)OC

InChI

InChI=1S/C13H19BrN2O3/c1-4-15-13(18)8(2)16-7-9-5-10(14)12(17)11(6-9)19-3/h5-6,8,16-17H,4,7H2,1-3H3,(H,15,18)