(3R)-3-azanyl-4-(2-fluorophenyl)-1-[4-phenyl-2-(phenylmethyl)piperazin-1-yl]butan-1-one

Systemtic Name: (3R)-3-azanyl-4-(2-fluorophenyl)-1-[4-phenyl-2-(phenylmethyl)piperazin-1-yl]butan-1-one Openeye Name: (3R)-3-amino-1-(2-benzyl-4-phenyl-piperazin-1-yl)-4-(2-fluorophenyl)butan-1-one CAS Name: (3R)-3-amino-4-(2-fluorophenyl)-1-[4-phenyl-2-(phenylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: (3R)-3-amino-1-(2-benzyl-4-phenylpiperazin-1-yl)-4-(2-fluorophenyl)butan-1-one Traditional Name: (3R)-3-amino-1-(2-benzyl-4-phenyl-piperazino)-4-(2-fluorophenyl)butan-1-one Formula: C27H30FN3O MolecularWeight: 431.545003

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C2=CC=CC=C2)CC3=CC=CC=C3)C(=O)CC(CC4=CC=CC=C4F)N

Isomeric SMILES

C1CN(C(CN1C2=CC=CC=C2)CC3=CC=CC=C3)C(=O)C[C@@H](CC4=CC=CC=C4F)N

InChI

InChI=1S/C27H30FN3O/c28-26-14-8-7-11-22(26)18-23(29)19-27(32)31-16-15-30(24-12-5-2-6-13-24)20-25(31)17-21-9-3-1-4-10-21/h1-14,23,25H,15-20,29H2/t23-,25?/m1/s1