1-(diphenylmethyl)-4-[3-(4-methoxyphenoxy)propyl]piperazin-4-ium

Systemtic Name: 1-(diphenylmethyl)-4-[3-(4-methoxyphenoxy)propyl]piperazin-4-ium Openeye Name: 1-benzhydryl-4-[3-(4-methoxyphenoxy)propyl]piperazin-4-ium CAS Name: 1-(diphenylmethyl)-4-[3-(4-methoxyphenoxy)propyl]piperazin-4-ium IUPAC Name: 1-benzhydryl-4-[3-(4-methoxyphenoxy)propyl]piperazin-4-ium Traditional Name: 1-benzhydryl-4-[3-(4-methoxyphenoxy)propyl]piperazin-4-ium Formula: C27H33N2O2+ MolecularWeight: 417.56312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCC[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)OCCC[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H32N2O2/c1-30-25-13-15-26(16-14-25)31-22-8-17-28-18-20-29(21-19-28)27(23-9-4-2-5-10-23)24-11-6-3-7-12-24/h2-7,9-16,27H,8,17-22H2,1H3/p+1