3-fluoranyl-1-[2-(2-methylpropyl)-4-(phenylmethyl)phenyl]piperazine

Systemtic Name: 3-fluoranyl-1-[2-(2-methylpropyl)-4-(phenylmethyl)phenyl]piperazine Openeye Name: 1-(4-benzyl-2-isobutyl-phenyl)-3-fluoro-piperazine CAS Name: 3-fluoro-1-[2-(2-methylpropyl)-4-(phenylmethyl)phenyl]piperazine IUPAC Name: 1-[4-benzyl-2-(2-methylpropyl)phenyl]-3-fluoropiperazine Traditional Name: 1-(4-benzyl-2-isobutyl-phenyl)-3-fluoro-piperazine Formula: C21H27FN2 MolecularWeight: 326.450883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=CC(=C1)CC2=CC=CC=C2)N3CCNC(C3)F

Isomeric SMILES

CC(C)CC1=C(C=CC(=C1)CC2=CC=CC=C2)N3CCNC(C3)F

InChI

InChI=1S/C21H27FN2/c1-16(2)12-19-14-18(13-17-6-4-3-5-7-17)8-9-20(19)24-11-10-23-21(22)15-24/h3-9,14,16,21,23H,10-13,15H2,1-2H3