phenyl 4-methylpiperazin-4-ium-1-carboxylate

Systemtic Name: phenyl 4-methylpiperazin-4-ium-1-carboxylate Openeye Name: phenyl 4-methylpiperazin-4-ium-1-carboxylate CAS Name: 4-methyl-1-piperazin-4-iumcarboxylic acid phenyl ester IUPAC Name: phenyl 4-methylpiperazin-4-ium-1-carboxylate Traditional Name: 4-methylpiperazin-4-ium-1-carboxylic acid phenyl ester Formula: C12H17N2O2+ MolecularWeight: 221.27558

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C12H16N2O2/c1-13-7-9-14(10-8-13)12(15)16-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3/p+1