1-(4-chloranyl-3-methyl-phenoxy)-4-(4-fluorophenyl)-4-piperazin-1-yl-butan-2-ol

Systemtic Name: 1-(4-chloranyl-3-methyl-phenoxy)-4-(4-fluorophenyl)-4-piperazin-1-yl-butan-2-ol Openeye Name: 1-(4-chloro-3-methyl-phenoxy)-4-(4-fluorophenyl)-4-piperazin-1-yl-butan-2-ol CAS Name: 1-(4-chloro-3-methylphenoxy)-4-(4-fluorophenyl)-4-(1-piperazinyl)-2-butanol IUPAC Name: 1-(4-chloro-3-methylphenoxy)-4-(4-fluorophenyl)-4-piperazin-1-ylbutan-2-ol Traditional Name: 1-(4-chloro-3-methyl-phenoxy)-4-(4-fluorophenyl)-4-piperazino-butan-2-ol Formula: C21H26ClFN2O2 MolecularWeight: 392.894743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(CC(C2=CC=C(C=C2)F)N3CCNCC3)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(CC(C2=CC=C(C=C2)F)N3CCNCC3)O)Cl

InChI

InChI=1S/C21H26ClFN2O2/c1-15-12-19(6-7-20(15)22)27-14-18(26)13-21(25-10-8-24-9-11-25)16-2-4-17(23)5-3-16/h2-7,12,18,21,24,26H,8-11,13-14H2,1H3