5-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]pentanoate

Systemtic Name: 5-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]pentanoate Openeye Name: 5-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]pentanoate CAS Name: 5-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]pentanoate IUPAC Name: 5-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]pentanoate Traditional Name: 5-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]valerate Formula: C16H24N2O3 MolecularWeight: 292.37336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CCCCC(=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CCCCC(=O)[O-]

InChI

InChI=1S/C16H24N2O3/c1-21-15-7-3-2-6-14(15)18-12-10-17(11-13-18)9-5-4-8-16(19)20/h2-3,6-7H,4-5,8-13H2,1H3,(H,19,20)