5,5-dimethyl-2-[2-[4-(2-phenylethanoyl)piperazin-1-yl]ethyliminomethyl]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[2-[4-(2-phenylethanoyl)piperazin-1-yl]ethyliminomethyl]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[2-[4-(2-phenylacetyl)piperazin-1-yl]ethyliminomethyl]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[2-[4-(1-oxo-2-phenylethyl)-1-piperazinyl]ethyliminomethyl]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[2-[4-(2-phenylacetyl)piperazin-1-yl]ethyliminomethyl]cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[2-[4-(2-phenylacetyl)piperazino]ethyliminomethyl]cyclohexane-1,3-quinone Formula: C23H31N3O3 MolecularWeight: 397.51054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C=NCCN2CCN(CC2)C(=O)CC3=CC=CC=C3)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C=NCCN2CCN(CC2)C(=O)CC3=CC=CC=C3)C

InChI

InChI=1S/C23H31N3O3/c1-23(2)15-20(27)19(21(28)16-23)17-24-8-9-25-10-12-26(13-11-25)22(29)14-18-6-4-3-5-7-18/h3-7,17,19H,8-16H2,1-2H3