1-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(1-adamantylamino)-2-oxo-ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-(1-adamantylamino)-2-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(1-adamantylamino)-2-oxoethyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(1-adamantylamino)-2-keto-ethyl]isonipecotic acid Formula: C18H28N2O3 MolecularWeight: 320.42652

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C1CN(CCC1C(=O)O)CC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H28N2O3/c21-16(11-20-3-1-15(2-4-20)17(22)23)19-18-8-12-5-13(9-18)7-14(6-12)10-18/h12-15H,1-11H2,(H,19,21)(H,22,23)