1-[1-(diphenylmethyl)piperazin-1-ium-1-yl]ethyl methanoate

Systemtic Name: 1-[1-(diphenylmethyl)piperazin-1-ium-1-yl]ethyl methanoate Openeye Name: 1-(1-benzhydrylpiperazin-1-ium-1-yl)ethyl formate CAS Name: formic acid 1-[1-(diphenylmethyl)-1-piperazin-1-iumyl]ethyl ester IUPAC Name: 1-(1-benzhydrylpiperazin-1-ium-1-yl)ethyl formate Traditional Name: formic acid 1-(1-benzhydrylpiperazin-1-ium-1-yl)ethyl ester Formula: C20H25N2O2+ MolecularWeight: 325.4247

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Descriptors Computed from Structure

Canonical SMILES:

CC([N+]1(CCNCC1)C(C2=CC=CC=C2)C3=CC=CC=C3)OC=O

Isomeric SMILES

CC([N+]1(CCNCC1)C(C2=CC=CC=C2)C3=CC=CC=C3)OC=O

InChI

InChI=1S/C20H25N2O2/c1-17(24-16-23)22(14-12-21-13-15-22)20(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,16-17,20-21H,12-15H2,1H3/q+1