[(2S)-2-(2-chloroethyl)piperidin-1-yl]-(3,4-dimethylphenyl)methanone

Systemtic Name: [(2S)-2-(2-chloroethyl)piperidin-1-yl]-(3,4-dimethylphenyl)methanone Openeye Name: [(2S)-2-(2-chloroethyl)-1-piperidyl]-(3,4-dimethylphenyl)methanone CAS Name: [(2S)-2-(2-chloroethyl)-1-piperidinyl]-(3,4-dimethylphenyl)methanone IUPAC Name: [(2S)-2-(2-chloroethyl)piperidin-1-yl]-(3,4-dimethylphenyl)methanone Traditional Name: [(2S)-2-(2-chloroethyl)piperidino]-(3,4-dimethylphenyl)methanone Formula: C16H22ClNO MolecularWeight: 279.80498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCCC2CCCl)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCCC[C@H]2CCCl)C

InChI

InChI=1S/C16H22ClNO/c1-12-6-7-14(11-13(12)2)16(19)18-10-4-3-5-15(18)8-9-17/h6-7,11,15H,3-5,8-10H2,1-2H3/t15-/m0/s1