(2R)-1-(2-fluorophenyl)-4-[(2S)-2-(phenylmethoxymethyl)-4-(phenylmethyl)piperazin-1-yl]butan-2-amine

Systemtic Name: (2R)-1-(2-fluorophenyl)-4-[(2S)-2-(phenylmethoxymethyl)-4-(phenylmethyl)piperazin-1-yl]butan-2-amine Openeye Name: (2R)-4-[(2S)-4-benzyl-2-(benzyloxymethyl)piperazin-1-yl]-1-(2-fluorophenyl)butan-2-amine CAS Name: (2R)-1-(2-fluorophenyl)-4-[(2S)-2-(phenylmethoxymethyl)-4-(phenylmethyl)-1-piperazinyl]-2-butanamine IUPAC Name: (2R)-4-[(2S)-4-benzyl-2-(phenylmethoxymethyl)piperazin-1-yl]-1-(2-fluorophenyl)butan-2-amine Traditional Name: [(1R)-3-[(2S)-2-(benzoxymethyl)-4-benzyl-piperazino]-1-(2-fluorobenzyl)propyl]amine Formula: C29H36FN3O MolecularWeight: 461.614043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1CC2=CC=CC=C2)COCC3=CC=CC=C3)CCC(CC4=CC=CC=C4F)N

Isomeric SMILES

C1CN([C@@H](CN1CC2=CC=CC=C2)COCC3=CC=CC=C3)CC[C@@H](CC4=CC=CC=C4F)N

InChI

InChI=1S/C29H36FN3O/c30-29-14-8-7-13-26(29)19-27(31)15-16-33-18-17-32(20-24-9-3-1-4-10-24)21-28(33)23-34-22-25-11-5-2-6-12-25/h1-14,27-28H,15-23,31H2/t27-,28-/m0/s1