2-(5-nitro-2-propan-2-yl-phenyl)butanamide

Systemtic Name: 2-(5-nitro-2-propan-2-yl-phenyl)butanamide Openeye Name: 2-(2-isopropyl-5-nitro-phenyl)butanamide CAS Name: 2-(5-nitro-2-propan-2-ylphenyl)butanamide IUPAC Name: 2-(5-nitro-2-propan-2-ylphenyl)butanamide Traditional Name: 2-(2-isopropyl-5-nitro-phenyl)butyramide Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O3/c1-4-10(13(14)16)12-7-9(15(17)18)5-6-11(12)8(2)3/h5-8,10H,4H2,1-3H3,(H2,14,16)