(2S)-2-phenyl-2-(4-propylpiperazin-1-ium-1-yl)ethanoate

Systemtic Name: (2S)-2-phenyl-2-(4-propylpiperazin-1-ium-1-yl)ethanoate Openeye Name: (2S)-2-phenyl-2-(4-propylpiperazin-1-ium-1-yl)acetate CAS Name: (2S)-2-phenyl-2-(4-propyl-1-piperazin-1-iumyl)acetate IUPAC Name: (2S)-2-phenyl-2-(4-propylpiperazin-1-ium-1-yl)acetate Traditional Name: (2S)-2-phenyl-2-(4-propylpiperazin-1-ium-1-yl)acetate Formula: C15H22N2O2 MolecularWeight: 262.34738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC[NH+](CC1)C(C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CCCN1CC[NH+](CC1)[C@@H](C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C15H22N2O2/c1-2-8-16-9-11-17(12-10-16)14(15(18)19)13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3,(H,18,19)/t14-/m0/s1