ethyl 4-[2-(3-chloranylphenoxy)ethyl]piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-[2-(3-chloranylphenoxy)ethyl]piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-[2-(3-chlorophenoxy)ethyl]piperazin-4-ium-1-carboxylate CAS Name: 4-[2-(3-chlorophenoxy)ethyl]-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-chlorophenoxy)ethyl]piperazin-4-ium-1-carboxylate Traditional Name: 4-[2-(3-chlorophenoxy)ethyl]piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C15H22ClN2O3+ MolecularWeight: 313.79978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH+](CC1)CCOC2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)N1CC[NH+](CC1)CCOC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H21ClN2O3/c1-2-20-15(19)18-8-6-17(7-9-18)10-11-21-14-5-3-4-13(16)12-14/h3-5,12H,2,6-11H2,1H3/p+1