ethyl 2-chloranyl-5-piperazin-1-yl-benzoate

Systemtic Name: ethyl 2-chloranyl-5-piperazin-1-yl-benzoate Openeye Name: ethyl 2-chloro-5-piperazin-1-yl-benzoate CAS Name: 2-chloro-5-(1-piperazinyl)benzoic acid ethyl ester IUPAC Name: ethyl 2-chloro-5-piperazin-1-ylbenzoate Traditional Name: 2-chloro-5-piperazino-benzoic acid ethyl ester Formula: C13H17ClN2O2 MolecularWeight: 268.73928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)N2CCNCC2)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)N2CCNCC2)Cl

InChI

InChI=1S/C13H17ClN2O2/c1-2-18-13(17)11-9-10(3-4-12(11)14)16-7-5-15-6-8-16/h3-4,9,15H,2,5-8H2,1H3