methyl 3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propanoate

Systemtic Name: methyl 3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propanoate Openeye Name: methyl 3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propanoate CAS Name: 3-[(2S)-4-methyl-2-phenyl-1-piperazin-4-iumyl]propanoic acid methyl ester IUPAC Name: methyl 3-[(2S)-4-methyl-2-phenylpiperazin-4-ium-1-yl]propanoate Traditional Name: 3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propionic acid methyl ester Formula: C15H23N2O2+ MolecularWeight: 263.35532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O2/c1-16-10-11-17(9-8-15(18)19-2)14(12-16)13-6-4-3-5-7-13/h3-7,14H,8-12H2,1-2H3/p+1/t14-/m1/s1