methyl 2-[4-(piperazin-4-ium-1-ylmethyl)phenoxy]ethanoate

Systemtic Name: methyl 2-[4-(piperazin-4-ium-1-ylmethyl)phenoxy]ethanoate Openeye Name: methyl 2-[4-(piperazin-4-ium-1-ylmethyl)phenoxy]acetate CAS Name: 2-[4-(1-piperazin-4-iumylmethyl)phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-(piperazin-4-ium-1-ylmethyl)phenoxy]acetate Traditional Name: 2-[4-(piperazin-4-ium-1-ylmethyl)phenoxy]acetic acid methyl ester Formula: C14H21N2O3+ MolecularWeight: 265.32814

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)CN2CC[NH2+]CC2

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)CN2CC[NH2+]CC2

InChI

InChI=1S/C14H20N2O3/c1-18-14(17)11-19-13-4-2-12(3-5-13)10-16-8-6-15-7-9-16/h2-5,15H,6-11H2,1H3/p+1