3,5,5-trimethyl-6-[(4-nitrophenyl)methyl]cyclohex-2-en-1-one

Systemtic Name: 3,5,5-trimethyl-6-[(4-nitrophenyl)methyl]cyclohex-2-en-1-one Openeye Name: 3,5,5-trimethyl-6-[(4-nitrophenyl)methyl]cyclohex-2-en-1-one CAS Name: 3,5,5-trimethyl-6-[(4-nitrophenyl)methyl]-1-cyclohex-2-enone IUPAC Name: 3,5,5-trimethyl-6-[(4-nitrophenyl)methyl]cyclohex-2-en-1-one Traditional Name: 3,5,5-trimethyl-6-(4-nitrobenzyl)cyclohex-2-en-1-one Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(C1)(C)C)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)C(C(C1)(C)C)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19NO3/c1-11-8-15(18)14(16(2,3)10-11)9-12-4-6-13(7-5-12)17(19)20/h4-8,14H,9-10H2,1-3H3