N-aminocarbonyl-2-bromanyl-2-ethyl-butanamide; 4-nitroaniline

Systemtic Name: N-aminocarbonyl-2-bromanyl-2-ethyl-butanamide; 4-nitroaniline Openeye Name: 2-bromo-N-carbamoyl-2-ethyl-butanamide; 4-nitroaniline CAS Name: 2-bromo-N-carbamoyl-2-ethylbutanamide; 4-nitroaniline IUPAC Name: 2-bromo-N-carbamoyl-2-ethylbutanamide; 4-nitroaniline Traditional Name: 2-bromo-N-carbamoyl-2-ethyl-butyramide; (4-nitrophenyl)amine Formula: C13H19BrN4O4 MolecularWeight: 375.21836

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)NC(=O)N)Br.C1=CC(=CC=C1N)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)(C(=O)NC(=O)N)Br.C1=CC(=CC=C1N)[N+](=O)[O-]

InChI

InChI=1S/C7H13BrN2O2.C6H6N2O2/c1-3-7(8,4-2)5(11)10-6(9)12;7-5-1-3-6(4-2-5)8(9)10/h3-4H2,1-2H3,(H3,9,10,11,12);1-4H,7H2