[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl] 2-[(2-chlorophenyl)methoxy]benzoate

Systemtic Name: [2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl] 2-[(2-chlorophenyl)methoxy]benzoate Openeye Name: [2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl] 2-[(2-chlorophenyl)methoxy]benzoate CAS Name: 2-[(2-chlorophenyl)methoxy]benzoic acid [2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl] 2-[(2-chlorophenyl)methoxy]benzoate Traditional Name: 2-(2-chlorobenzyl)oxybenzoic acid [2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)ethyl] ester Formula: C25H25ClN3O4+ MolecularWeight: 466.9367

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)COC(=O)C3=CC=CC=C3OCC4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)COC(=O)C3=CC=CC=C3OCC4=CC=CC=C4Cl

InChI

InChI=1S/C25H24ClN3O4/c26-21-9-3-1-7-19(21)17-32-22-10-4-2-8-20(22)25(31)33-18-24(30)29-15-13-28(14-16-29)23-11-5-6-12-27-23/h1-12H,13-18H2/p+1