(2S)-2-(2,4-dimethylphenoxy)-3-methyl-1-piperazin-1-yl-butan-1-one

Systemtic Name: (2S)-2-(2,4-dimethylphenoxy)-3-methyl-1-piperazin-1-yl-butan-1-one Openeye Name: (2S)-2-(2,4-dimethylphenoxy)-3-methyl-1-piperazin-1-yl-butan-1-one CAS Name: (2S)-2-(2,4-dimethylphenoxy)-3-methyl-1-(1-piperazinyl)-1-butanone IUPAC Name: (2S)-2-(2,4-dimethylphenoxy)-3-methyl-1-piperazin-1-ylbutan-1-one Traditional Name: (2S)-2-(2,4-dimethylphenoxy)-3-methyl-1-piperazino-butan-1-one Formula: C17H26N2O2 MolecularWeight: 290.40054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(C(C)C)C(=O)N2CCNCC2)C

Isomeric SMILES

CC1=CC(=C(C=C1)O[C@@H](C(C)C)C(=O)N2CCNCC2)C

InChI

InChI=1S/C17H26N2O2/c1-12(2)16(17(20)19-9-7-18-8-10-19)21-15-6-5-13(3)11-14(15)4/h5-6,11-12,16,18H,7-10H2,1-4H3/t16-/m0/s1