ethyl (3R)-3-phenylpiperazin-4-ium-1-carboxylate

Systemtic Name: ethyl (3R)-3-phenylpiperazin-4-ium-1-carboxylate Openeye Name: ethyl (3R)-3-phenylpiperazin-4-ium-1-carboxylate CAS Name: (3R)-3-phenyl-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-phenylpiperazin-4-ium-1-carboxylate Traditional Name: (3R)-3-phenylpiperazin-4-ium-1-carboxylic acid ethyl ester Formula: C13H19N2O2+ MolecularWeight: 235.30216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH2+]C(C1)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)N1CC[NH2+][C@@H](C1)C2=CC=CC=C2

InChI

InChI=1S/C13H18N2O2/c1-2-17-13(16)15-9-8-14-12(10-15)11-6-4-3-5-7-11/h3-7,12,14H,2,8-10H2,1H3/p+1/t12-/m0/s1