1-[4-chloranyl-3-(1-fluoranylbutyl)-5-(2-methylphenyl)phenyl]-4-ethyl-piperazine

Systemtic Name: 1-[4-chloranyl-3-(1-fluoranylbutyl)-5-(2-methylphenyl)phenyl]-4-ethyl-piperazine Openeye Name: 1-[4-chloro-3-(1-fluorobutyl)-5-(o-tolyl)phenyl]-4-ethyl-piperazine CAS Name: 1-[4-chloro-3-(1-fluorobutyl)-5-(2-methylphenyl)phenyl]-4-ethylpiperazine IUPAC Name: 1-[4-chloro-3-(1-fluorobutyl)-5-(2-methylphenyl)phenyl]-4-ethylpiperazine Traditional Name: 1-[4-chloro-3-(1-fluorobutyl)-5-(o-tolyl)phenyl]-4-ethyl-piperazine Formula: C23H30ClFN2 MolecularWeight: 388.949103

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(C(=CC(=C1)N2CCN(CC2)CC)C3=CC=CC=C3C)Cl)F

Isomeric SMILES

CCCC(C1=C(C(=CC(=C1)N2CCN(CC2)CC)C3=CC=CC=C3C)Cl)F

InChI

InChI=1S/C23H30ClFN2/c1-4-8-22(25)21-16-18(27-13-11-26(5-2)12-14-27)15-20(23(21)24)19-10-7-6-9-17(19)3/h6-7,9-10,15-16,22H,4-5,8,11-14H2,1-3H3