2-[(4-bromanyl-3-nitro-phenyl)methylamino]-N-propyl-ethanamide

Systemtic Name: 2-[(4-bromanyl-3-nitro-phenyl)methylamino]-N-propyl-ethanamide Openeye Name: 2-[(4-bromo-3-nitro-phenyl)methylamino]-N-propyl-acetamide CAS Name: 2-[(4-bromo-3-nitrophenyl)methylamino]-N-propylacetamide IUPAC Name: 2-[(4-bromo-3-nitrophenyl)methylamino]-N-propylacetamide Traditional Name: 2-[(4-bromo-3-nitro-benzyl)amino]-N-propyl-acetamide Formula: C12H16BrN3O3 MolecularWeight: 330.17774

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)CNCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H16BrN3O3/c1-2-5-15-12(17)8-14-7-9-3-4-10(13)11(6-9)16(18)19/h3-4,6,14H,2,5,7-8H2,1H3,(H,15,17)