2-(4-methylpiperazin-4-ium-1-yl)ethyl 2-oxidanyl-2,2-diphenyl-ethanoate

Systemtic Name: 2-(4-methylpiperazin-4-ium-1-yl)ethyl 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: 2-(4-methylpiperazin-4-ium-1-yl)ethyl 2-hydroxy-2,2-diphenyl-acetate CAS Name: 2-hydroxy-2,2-diphenylacetic acid 2-(4-methyl-1-piperazin-4-iumyl)ethyl ester IUPAC Name: 2-(4-methylpiperazin-4-ium-1-yl)ethyl 2-hydroxy-2,2-diphenylacetate Traditional Name: 2-hydroxy-2,2-diphenyl-acetic acid 2-(4-methylpiperazin-4-ium-1-yl)ethyl ester Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3/c1-22-12-14-23(15-13-22)16-17-26-20(24)21(25,18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,25H,12-17H2,1H3/p+1