2-(3-nitro-2-propan-2-yl-phenyl)butanamide

Systemtic Name: 2-(3-nitro-2-propan-2-yl-phenyl)butanamide Openeye Name: 2-(2-isopropyl-3-nitro-phenyl)butanamide CAS Name: 2-(3-nitro-2-propan-2-ylphenyl)butanamide IUPAC Name: 2-(3-nitro-2-propan-2-ylphenyl)butanamide Traditional Name: 2-(2-isopropyl-3-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/c1-4-9(13(14)16)10-6-5-7-11(15(17)18)12(10)8(2)3/h5-9H,4H2,1-3H3,(H2,14,16)