N-[2-(1-adamantyl)ethyl]-1-oxidanidyl-pyridin-1-ium-4-carboxamide hydrochloride

Systemtic Name: N-[2-(1-adamantyl)ethyl]-1-oxidanidyl-pyridin-1-ium-4-carboxamide hydrochloride Openeye Name: N-[2-(1-adamantyl)ethyl]-1-oxido-pyridin-1-ium-4-carboxamide hydrochloride CAS Name: N-[2-(1-adamantyl)ethyl]-1-oxido-4-pyridin-1-iumcarboxamide hydrochloride IUPAC Name: N-[2-(1-adamantyl)ethyl]-1-oxidopyridin-1-ium-4-carboxamide hydrochloride Traditional Name: N-[2-(1-adamantyl)ethyl]-1-oxido-pyridin-1-ium-4-carboxamide hydrochloride Formula: C18H25ClN2O2 MolecularWeight: 336.8563

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCNC(=O)C4=CC=[N+](C=C4)[O-].Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCNC(=O)C4=CC=[N+](C=C4)[O-].Cl

InChI

InChI=1S/C18H24N2O2.ClH/c21-17(16-1-5-20(22)6-2-16)19-4-3-18-10-13-7-14(11-18)9-15(8-13)12-18;/h1-2,5-6,13-15H,3-4,7-12H2,(H,19,21);1H