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

Systemtic Name: 3-ethoxy-5,5-dimethyl-6-[(4-nitrophenyl)methyl]cyclohex-2-en-1-one Openeye Name: 3-ethoxy-5,5-dimethyl-6-[(4-nitrophenyl)methyl]cyclohex-2-en-1-one CAS Name: 3-ethoxy-5,5-dimethyl-6-[(4-nitrophenyl)methyl]-1-cyclohex-2-enone IUPAC Name: 3-ethoxy-5,5-dimethyl-6-[(4-nitrophenyl)methyl]cyclohex-2-en-1-one Traditional Name: 3-ethoxy-5,5-dimethyl-6-(4-nitrobenzyl)cyclohex-2-en-1-one Formula: C17H21NO4 MolecularWeight: 303.35294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=O)C(C(C1)(C)C)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=O)C(C(C1)(C)C)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H21NO4/c1-4-22-14-10-16(19)15(17(2,3)11-14)9-12-5-7-13(8-6-12)18(20)21/h5-8,10,15H,4,9,11H2,1-3H3