methyl 2-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]ethanoate

Systemtic Name: methyl 2-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]ethanoate Openeye Name: methyl 2-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]acetate CAS Name: 2-[(2S)-4-methyl-2-phenyl-1-piperazine-1,4-diiumyl]acetic acid methyl ester IUPAC Name: methyl 2-[(2S)-4-methyl-2-phenylpiperazine-1,4-diium-1-yl]acetate Traditional Name: 2-[(2S)-4-methyl-2-phenyl-piperazine-1,4-diium-1-yl]acetic acid methyl ester Formula: C14H22N2O2+2 MolecularWeight: 250.33668

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](C(C1)C2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

C[NH+]1CC[NH+]([C@H](C1)C2=CC=CC=C2)CC(=O)OC

InChI

InChI=1S/C14H20N2O2/c1-15-8-9-16(11-14(17)18-2)13(10-15)12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3/p+2/t13-/m1/s1