(2S)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-methyl-butan-1-one

Systemtic Name: (2S)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-methyl-butan-1-one Openeye Name: (2S)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-methyl-butan-1-one CAS Name: (2S)-1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-methyl-1-butanone IUPAC Name: (2S)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-methylbutan-1-one Traditional Name: (2S)-1-[4-(2,3-dimethylphenyl)piperazino]-2-methyl-butan-1-one Formula: C17H26N2O MolecularWeight: 274.40114

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)N1CCN(CC1)C2=CC=CC(=C2C)C

Isomeric SMILES

CC[C@H](C)C(=O)N1CCN(CC1)C2=CC=CC(=C2C)C

InChI

InChI=1S/C17H26N2O/c1-5-13(2)17(20)19-11-9-18(10-12-19)16-8-6-7-14(3)15(16)4/h6-8,13H,5,9-12H2,1-4H3/t13-/m0/s1