(2S)-2-[(2,5-dimethylphenyl)amino]-1-[(3S)-3-methylpiperidin-1-yl]propan-1-one

Systemtic Name: (2S)-2-[(2,5-dimethylphenyl)amino]-1-[(3S)-3-methylpiperidin-1-yl]propan-1-one Openeye Name: (2S)-2-(2,5-dimethylanilino)-1-[(3S)-3-methyl-1-piperidyl]propan-1-one CAS Name: (2S)-2-(2,5-dimethylanilino)-1-[(3S)-3-methyl-1-piperidinyl]-1-propanone IUPAC Name: (2S)-2-(2,5-dimethylanilino)-1-[(3S)-3-methylpiperidin-1-yl]propan-1-one Traditional Name: (2S)-2-(2,5-dimethylanilino)-1-[(3S)-3-methylpiperidino]propan-1-one Formula: C17H26N2O MolecularWeight: 274.40114

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C(C)NC2=C(C=CC(=C2)C)C

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)[C@H](C)NC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C17H26N2O/c1-12-7-8-14(3)16(10-12)18-15(4)17(20)19-9-5-6-13(2)11-19/h7-8,10,13,15,18H,5-6,9,11H2,1-4H3/t13-,15-/m0/s1