4-(2-piperazin-1-ylethyl)benzoic acid

Systemtic Name: 4-(2-piperazin-1-ylethyl)benzoic acid Openeye Name: 4-(2-piperazin-1-ylethyl)benzoic acid CAS Name: 4-[2-(1-piperazinyl)ethyl]benzoic acid IUPAC Name: 4-(2-piperazin-1-ylethyl)benzoic acid Traditional Name: 4-(2-piperazinoethyl)benzoic acid Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CN(CCN1)CCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H18N2O2/c16-13(17)12-3-1-11(2-4-12)5-8-15-9-6-14-7-10-15/h1-4,14H,5-10H2,(H,16,17)