2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[(2-chloranyl-6-fluoranyl-phenyl)methyl-methyl-amino]-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone Openeye Name: 2-[(2-chloro-6-fluoro-phenyl)methyl-methyl-amino]-1-[4-(m-tolyl)piperazin-1-yl]ethanone CAS Name: 2-[(2-chloro-6-fluorophenyl)methyl-methylamino]-1-[4-(3-methylphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(2-chloro-6-fluorophenyl)methyl-methylamino]-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)-methyl-amino]-1-[4-(m-tolyl)piperazino]ethanone Formula: C21H25ClFN3O MolecularWeight: 389.894103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CN(C)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CN(C)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H25ClFN3O/c1-16-5-3-6-17(13-16)25-9-11-26(12-10-25)21(27)15-24(2)14-18-19(22)7-4-8-20(18)23/h3-8,13H,9-12,14-15H2,1-2H3