N-[(4-bromanyl-3-nitro-phenyl)methyl]-1-(2-methoxyethyl)pyrazol-4-amine

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-1-(2-methoxyethyl)pyrazol-4-amine Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-1-(2-methoxyethyl)pyrazol-4-amine CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-(2-methoxyethyl)-4-pyrazolamine IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-(2-methoxyethyl)pyrazol-4-amine Traditional Name: (4-bromo-3-nitro-benzyl)-[1-(2-methoxyethyl)pyrazol-4-yl]amine Formula: C13H15BrN4O3 MolecularWeight: 355.1872

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=C(C=N1)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

COCCN1C=C(C=N1)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H15BrN4O3/c1-21-5-4-17-9-11(8-16-17)15-7-10-2-3-12(14)13(6-10)18(19)20/h2-3,6,8-9,15H,4-5,7H2,1H3