2-cyclopropyl-4,4-dimethyl-2-(4-nitrophenyl)-3-oxidanylidene-pentanal

Systemtic Name: 2-cyclopropyl-4,4-dimethyl-2-(4-nitrophenyl)-3-oxidanylidene-pentanal Openeye Name: 2-cyclopropyl-4,4-dimethyl-2-(4-nitrophenyl)-3-oxo-pentanal CAS Name: 2-cyclopropyl-4,4-dimethyl-2-(4-nitrophenyl)-3-oxopentanal IUPAC Name: 2-cyclopropyl-4,4-dimethyl-2-(4-nitrophenyl)-3-oxopentanal Traditional Name: 2-cyclopropyl-3-keto-4,4-dimethyl-2-(4-nitrophenyl)valeraldehyde Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(C=O)(C1CC1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(=O)C(C=O)(C1CC1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19NO4/c1-15(2,3)14(19)16(10-18,11-4-5-11)12-6-8-13(9-7-12)17(20)21/h6-11H,4-5H2,1-3H3