methyl 3-[(4-bromanyl-3-nitro-phenyl)methylamino]propanoate

Systemtic Name: methyl 3-[(4-bromanyl-3-nitro-phenyl)methylamino]propanoate Openeye Name: methyl 3-[(4-bromo-3-nitro-phenyl)methylamino]propanoate CAS Name: 3-[(4-bromo-3-nitrophenyl)methylamino]propanoic acid methyl ester IUPAC Name: methyl 3-[(4-bromo-3-nitrophenyl)methylamino]propanoate Traditional Name: 3-[(4-bromo-3-nitro-benzyl)amino]propionic acid methyl ester Formula: C11H13BrN2O4 MolecularWeight: 317.13592

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCNCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

InChI

InChI=1S/C11H13BrN2O4/c1-18-11(15)4-5-13-7-8-2-3-9(12)10(6-8)14(16)17/h2-3,6,13H,4-5,7H2,1H3