piperidin-1-ium; 2-piperidin-1-ylcarbonylbenzoate

Systemtic Name: piperidin-1-ium; 2-piperidin-1-ylcarbonylbenzoate Openeye Name: 2-(piperidine-1-carbonyl)benzoate; piperidin-1-ium CAS Name: 2-[oxo(1-piperidinyl)methyl]benzoate; piperidin-1-ium IUPAC Name: 2-(piperidine-1-carbonyl)benzoate; piperidin-1-ium Traditional Name: 2-(piperidine-1-carbonyl)benzoate; piperidin-1-ium Formula: C18H26N2O3 MolecularWeight: 318.41064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH2+]CC1.C1CCN(CC1)C(=O)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C1CC[NH2+]CC1.C1CCN(CC1)C(=O)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C13H15NO3.C5H11N/c15-12(14-8-4-1-5-9-14)10-6-2-3-7-11(10)13(16)17;1-2-4-6-5-3-1/h2-3,6-7H,1,4-5,8-9H2,(H,16,17);6H,1-5H2