(E)-4,4-dimethyl-1-(4-nitrophenyl)pent-2-en-1-one

Systemtic Name: (E)-4,4-dimethyl-1-(4-nitrophenyl)pent-2-en-1-one Openeye Name: (E)-4,4-dimethyl-1-(4-nitrophenyl)pent-2-en-1-one CAS Name: (E)-4,4-dimethyl-1-(4-nitrophenyl)-2-penten-1-one IUPAC Name: (E)-4,4-dimethyl-1-(4-nitrophenyl)pent-2-en-1-one Traditional Name: (E)-4,4-dimethyl-1-(4-nitrophenyl)pent-2-en-1-one Formula: C13H15NO3 MolecularWeight: 233.2631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO3/c1-13(2,3)9-8-12(15)10-4-6-11(7-5-10)14(16)17/h4-9H,1-3H3/b9-8+