5,5-dimethyl-3-oxidanyl-2-[(S)-oxidanyl-[2-piperazin-1-ylethyl(propyl)amino]methyl]cyclohex-2-en-1-one

Systemtic Name: 5,5-dimethyl-3-oxidanyl-2-[(S)-oxidanyl-[2-piperazin-1-ylethyl(propyl)amino]methyl]cyclohex-2-en-1-one Openeye Name: 3-hydroxy-2-[(S)-hydroxy-[2-piperazin-1-ylethyl(propyl)amino]methyl]-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-hydroxy-2-[(S)-hydroxy-[2-(1-piperazinyl)ethyl-propylamino]methyl]-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-hydroxy-2-[(S)-hydroxy-[2-piperazin-1-ylethyl(propyl)amino]methyl]-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-hydroxy-2-[(S)-hydroxy-[2-piperazinoethyl(propyl)amino]methyl]-5,5-dimethyl-cyclohex-2-en-1-one Formula: C18H33N3O3 MolecularWeight: 339.47292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCN1CCNCC1)C(C2=C(CC(CC2=O)(C)C)O)O

Isomeric SMILES

CCCN(CCN1CCNCC1)[C@H](C2=C(CC(CC2=O)(C)C)O)O

InChI

InChI=1S/C18H33N3O3/c1-4-7-21(11-10-20-8-5-19-6-9-20)17(24)16-14(22)12-18(2,3)13-15(16)23/h17,19,22,24H,4-13H2,1-3H3/t17-/m0/s1