4-piperidin-4-ylcarbonylbenzoic acid hydrochloride

Systemtic Name: 4-piperidin-4-ylcarbonylbenzoic acid hydrochloride Openeye Name: 4-(piperidine-4-carbonyl)benzoic acid hydrochloride CAS Name: 4-[oxo(4-piperidinyl)methyl]benzoic acid hydrochloride IUPAC Name: 4-(piperidine-4-carbonyl)benzoic acid hydrochloride Traditional Name: 4-isonipecotoylbenzoic acid hydrochloride Formula: C13H16ClNO3 MolecularWeight: 269.72404

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(=O)C2=CC=C(C=C2)C(=O)O.Cl

Isomeric SMILES

C1CNCCC1C(=O)C2=CC=C(C=C2)C(=O)O.Cl

InChI

InChI=1S/C13H15NO3.ClH/c15-12(10-5-7-14-8-6-10)9-1-3-11(4-2-9)13(16)17;/h1-4,10,14H,5-8H2,(H,16,17);1H