2-[(4-bromanyl-3-nitro-phenyl)methylamino]-N-ethyl-propanamide

Systemtic Name: 2-[(4-bromanyl-3-nitro-phenyl)methylamino]-N-ethyl-propanamide Openeye Name: 2-[(4-bromo-3-nitro-phenyl)methylamino]-N-ethyl-propanamide CAS Name: 2-[(4-bromo-3-nitrophenyl)methylamino]-N-ethylpropanamide IUPAC Name: 2-[(4-bromo-3-nitrophenyl)methylamino]-N-ethylpropanamide Traditional Name: 2-[(4-bromo-3-nitro-benzyl)amino]-N-ethyl-propionamide Formula: C12H16BrN3O3 MolecularWeight: 330.17774

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)C(C)NCC1=CC(=C(C=C1)Br)[N+](=O)[O-]

InChI

InChI=1S/C12H16BrN3O3/c1-3-14-12(17)8(2)15-7-9-4-5-10(13)11(6-9)16(18)19/h4-6,8,15H,3,7H2,1-2H3,(H,14,17)