(2S)-2-(2-chloranyl-5-methyl-phenoxy)-1-(4-ethylpiperazin-1-yl)butan-1-one

Systemtic Name: (2S)-2-(2-chloranyl-5-methyl-phenoxy)-1-(4-ethylpiperazin-1-yl)butan-1-one Openeye Name: (2S)-2-(2-chloro-5-methyl-phenoxy)-1-(4-ethylpiperazin-1-yl)butan-1-one CAS Name: (2S)-2-(2-chloro-5-methylphenoxy)-1-(4-ethyl-1-piperazinyl)-1-butanone IUPAC Name: (2S)-2-(2-chloro-5-methylphenoxy)-1-(4-ethylpiperazin-1-yl)butan-1-one Traditional Name: (2S)-2-(2-chloro-5-methyl-phenoxy)-1-(4-ethylpiperazino)butan-1-one Formula: C17H25ClN2O2 MolecularWeight: 324.8456

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCN(CC1)CC)OC2=C(C=CC(=C2)C)Cl

Isomeric SMILES

CC[C@@H](C(=O)N1CCN(CC1)CC)OC2=C(C=CC(=C2)C)Cl

InChI

InChI=1S/C17H25ClN2O2/c1-4-15(22-16-12-13(3)6-7-14(16)18)17(21)20-10-8-19(5-2)9-11-20/h6-7,12,15H,4-5,8-11H2,1-3H3/t15-/m0/s1