O1-ethyl O1'-phenyl piperazin-1-ium-1,1-dicarboxylate

Systemtic Name: O1-ethyl O1'-phenyl piperazin-1-ium-1,1-dicarboxylate Openeye Name: O1-ethyl O1'-phenyl piperazin-1-ium-1,1-dicarboxylate CAS Name: piperazin-1-ium-1,1-dicarboxylic acid O1-ethyl ester O1'-phenyl ester IUPAC Name: 1-O-ethyl 1-O'-phenyl piperazin-1-ium-1,1-dicarboxylate Traditional Name: piperazin-1-ium-1,1-dicarboxylic acid O1-ethyl ester O1'-phenyl ester Formula: C14H19N2O4+ MolecularWeight: 279.31166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)[N+]1(CCNCC1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[N+]1(CCNCC1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C14H19N2O4/c1-2-19-13(17)16(10-8-15-9-11-16)14(18)20-12-6-4-3-5-7-12/h3-7,15H,2,8-11H2,1H3/q+1