N-(4-butan-2-ylphenyl)-2-nitro-ethanamide

Systemtic Name: N-(4-butan-2-ylphenyl)-2-nitro-ethanamide Openeye Name: 2-nitro-N-(4-sec-butylphenyl)acetamide CAS Name: N-(4-butan-2-ylphenyl)-2-nitroacetamide IUPAC Name: N-(4-butan-2-ylphenyl)-2-nitroacetamide Traditional Name: 2-nitro-N-(4-sec-butylphenyl)acetamide Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O3/c1-3-9(2)10-4-6-11(7-5-10)13-12(15)8-14(16)17/h4-7,9H,3,8H2,1-2H3,(H,13,15)