4,5,5-trimethyl-1-(4-nitrophenyl)piperazin-2-one

Systemtic Name: 4,5,5-trimethyl-1-(4-nitrophenyl)piperazin-2-one Openeye Name: 4,5,5-trimethyl-1-(4-nitrophenyl)piperazin-2-one CAS Name: 4,5,5-trimethyl-1-(4-nitrophenyl)-2-piperazinone IUPAC Name: 4,5,5-trimethyl-1-(4-nitrophenyl)piperazin-2-one Traditional Name: 4,5,5-trimethyl-1-(4-nitrophenyl)piperazin-2-one Formula: C13H17N3O3 MolecularWeight: 263.29238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)CN1C)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1(CN(C(=O)CN1C)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C13H17N3O3/c1-13(2)9-15(12(17)8-14(13)3)10-4-6-11(7-5-10)16(18)19/h4-7H,8-9H2,1-3H3