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

Systemtic Name: 3-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylamino]propanamide Openeye Name: 3-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylamino]propanamide CAS Name: 3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylamino]propanamide IUPAC Name: 3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylamino]propanamide Traditional Name: 3-[(3-bromo-4-hydroxy-5-methoxy-benzyl)amino]propionamide Formula: C11H15BrN2O3 MolecularWeight: 303.1524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCCC(=O)N)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)CNCCC(=O)N)Br)O

InChI

InChI=1S/C11H15BrN2O3/c1-17-9-5-7(4-8(12)11(9)16)6-14-3-2-10(13)15/h4-5,14,16H,2-3,6H2,1H3,(H2,13,15)