3-[4-(diphenylmethyl)piperazin-1-ium-1-yl]propanoate

Systemtic Name: 3-[4-(diphenylmethyl)piperazin-1-ium-1-yl]propanoate Openeye Name: 3-(4-benzhydrylpiperazin-1-ium-1-yl)propanoate CAS Name: 3-[4-(diphenylmethyl)-1-piperazin-1-iumyl]propanoate IUPAC Name: 3-(4-benzhydrylpiperazin-1-ium-1-yl)propanoate Traditional Name: 3-(4-benzhydrylpiperazin-1-ium-1-yl)propionate Formula: C20H24N2O2 MolecularWeight: 324.41676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)[O-])C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)[O-])C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H24N2O2/c23-19(24)11-12-21-13-15-22(16-14-21)20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,20H,11-16H2,(H,23,24)