1-[3-(2-fluorophenyl)-3-(3-methyl-5-propan-2-yl-phenoxy)propyl]-4-(phenylmethyl)piperazine

Systemtic Name: 1-[3-(2-fluorophenyl)-3-(3-methyl-5-propan-2-yl-phenoxy)propyl]-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-[3-(2-fluorophenyl)-3-(3-isopropyl-5-methyl-phenoxy)propyl]piperazine CAS Name: 1-[3-(2-fluorophenyl)-3-(3-methyl-5-propan-2-ylphenoxy)propyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-[3-(2-fluorophenyl)-3-(3-methyl-5-propan-2-ylphenoxy)propyl]piperazine Traditional Name: 1-benzyl-4-[3-(2-fluorophenyl)-3-(3-isopropyl-5-methyl-phenoxy)propyl]piperazine Formula: C30H37FN2O MolecularWeight: 460.625983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(CCN2CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4F)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC(CCN2CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4F)C(C)C

InChI

InChI=1S/C30H37FN2O/c1-23(2)26-19-24(3)20-27(21-26)34-30(28-11-7-8-12-29(28)31)13-14-32-15-17-33(18-16-32)22-25-9-5-4-6-10-25/h4-12,19-21,23,30H,13-18,22H2,1-3H3