(2S)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-(2-methoxyphenoxy)propan-1-one

Systemtic Name: (2S)-1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-(2-methoxyphenoxy)propan-1-one Openeye Name: (2S)-1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-2-(2-methoxyphenoxy)propan-1-one CAS Name: (2S)-1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-(2-methoxyphenoxy)-1-propanone IUPAC Name: (2S)-1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-(2-methoxyphenoxy)propan-1-one Traditional Name: (2S)-1-[4-(5-chloro-2-methyl-phenyl)piperazino]-2-(2-methoxyphenoxy)propan-1-one Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)C(C)OC3=CC=CC=C3OC

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)[C@H](C)OC3=CC=CC=C3OC

InChI

InChI=1S/C21H25ClN2O3/c1-15-8-9-17(22)14-18(15)23-10-12-24(13-11-23)21(25)16(2)27-20-7-5-4-6-19(20)26-3/h4-9,14,16H,10-13H2,1-3H3/t16-/m0/s1