1-(4-tert-butyl-3-nitro-phenyl)-5-cyclohexyl-pentan-2-one

Systemtic Name: 1-(4-tert-butyl-3-nitro-phenyl)-5-cyclohexyl-pentan-2-one Openeye Name: 1-(4-tert-butyl-3-nitro-phenyl)-5-cyclohexyl-pentan-2-one CAS Name: 1-(4-tert-butyl-3-nitrophenyl)-5-cyclohexyl-2-pentanone IUPAC Name: 1-(4-tert-butyl-3-nitrophenyl)-5-cyclohexylpentan-2-one Traditional Name: 1-(4-tert-butyl-3-nitro-phenyl)-5-cyclohexyl-pentan-2-one Formula: C21H31NO3 MolecularWeight: 345.47574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C(C=C1)CC(=O)CCCC2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=C(C=C(C=C1)CC(=O)CCCC2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C21H31NO3/c1-21(2,3)19-13-12-17(15-20(19)22(24)25)14-18(23)11-7-10-16-8-5-4-6-9-16/h12-13,15-16H,4-11,14H2,1-3H3