methyl (2S)-2-(4-fluorophenyl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanoate

Systemtic Name: methyl (2S)-2-(4-fluorophenyl)-2-[4-(phenylmethyl)piperazin-1-yl]ethanoate Openeye Name: methyl (2S)-2-(4-benzylpiperazin-1-yl)-2-(4-fluorophenyl)acetate CAS Name: (2S)-2-(4-fluorophenyl)-2-[4-(phenylmethyl)-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl (2S)-2-(4-benzylpiperazin-1-yl)-2-(4-fluorophenyl)acetate Traditional Name: (2S)-2-(4-benzylpiperazino)-2-(4-fluorophenyl)acetic acid methyl ester Formula: C20H23FN2O2 MolecularWeight: 342.407223

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)F)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H](C1=CC=C(C=C1)F)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H23FN2O2/c1-25-20(24)19(17-7-9-18(21)10-8-17)23-13-11-22(12-14-23)15-16-5-3-2-4-6-16/h2-10,19H,11-15H2,1H3/t19-/m0/s1