2-(4-chloranyl-2-methyl-phenoxy)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-1-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(4-chloro-2-methyl-phenoxy)propan-1-one CAS Name: 2-(4-chloro-2-methylphenoxy)-1-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(4-chloro-2-methylphenoxy)propan-1-one Traditional Name: 1-(4-benzylpiperazino)-2-(4-chloro-2-methyl-phenoxy)propan-1-one Formula: C21H25ClN2O2 MolecularWeight: 372.8884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(C)C(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC(C)C(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H25ClN2O2/c1-16-14-19(22)8-9-20(16)26-17(2)21(25)24-12-10-23(11-13-24)15-18-6-4-3-5-7-18/h3-9,14,17H,10-13,15H2,1-2H3