3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2,2-dimethyl-propanoate

Systemtic Name: 3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2,2-dimethyl-propanoate Openeye Name: 3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2,2-dimethyl-propanoate CAS Name: 3-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-2,2-dimethylpropanoate IUPAC Name: 3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2,2-dimethylpropanoate Traditional Name: 3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-2,2-dimethyl-propionate Formula: C16H24N2O3 MolecularWeight: 292.37336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH+]1CCN(CC1)C2=CC=CC=C2OC)C(=O)[O-]

Isomeric SMILES

CC(C)(C[NH+]1CCN(CC1)C2=CC=CC=C2OC)C(=O)[O-]

InChI

InChI=1S/C16H24N2O3/c1-16(2,15(19)20)12-17-8-10-18(11-9-17)13-6-4-5-7-14(13)21-3/h4-7H,8-12H2,1-3H3,(H,19,20)