4-(piperazin-1-ylmethyl)benzoic acid dihydrochloride

Systemtic Name: 4-(piperazin-1-ylmethyl)benzoic acid dihydrochloride Openeye Name: 4-(piperazin-1-ylmethyl)benzoic acid dihydrochloride CAS Name: 4-(1-piperazinylmethyl)benzoic acid dihydrochloride IUPAC Name: 4-(piperazin-1-ylmethyl)benzoic acid dihydrochloride Traditional Name: 4-(piperazinomethyl)benzoic acid dihydrochloride Formula: C12H18Cl2N2O2 MolecularWeight: 293.18952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2=CC=C(C=C2)C(=O)O.Cl.Cl

Isomeric SMILES

C1CN(CCN1)CC2=CC=C(C=C2)C(=O)O.Cl.Cl

InChI

InChI=1S/C12H16N2O2.2ClH/c15-12(16)11-3-1-10(2-4-11)9-14-7-5-13-6-8-14;;/h1-4,13H,5-9H2,(H,15,16);2*1H