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

Systemtic Name: methyl 2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]ethanoate Openeye Name: methyl 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)acetate CAS Name: 2-[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]acetic acid methyl ester IUPAC Name: methyl 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)acetate Traditional Name: 2-(4-benzhydrylpiperazine-1,4-diium-1-yl)acetic acid methyl ester Formula: C20H26N2O2+2 MolecularWeight: 326.43264

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C[NH+]1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C[NH+]1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H24N2O2/c1-24-19(23)16-21-12-14-22(15-13-21)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,20H,12-16H2,1H3/p+2