N-[2-oxidanylidene-2-[(3-oxidanylpyridin-1-ium-2-yl)amino]ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[(3-oxidanylpyridin-1-ium-2-yl)amino]ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[(3-hydroxypyridin-1-ium-2-yl)amino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[(3-hydroxy-2-pyridin-1-iumyl)amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[(3-hydroxypyridin-1-ium-2-yl)amino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-[(3-hydroxypyridin-1-ium-2-yl)amino]-2-keto-ethyl]adamantane-1-carboxamide Formula: C18H24N3O3+ MolecularWeight: 330.40146

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NC4=C(C=CC=[NH+]4)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NC4=C(C=CC=[NH+]4)O

InChI

InChI=1S/C18H23N3O3/c22-14-2-1-3-19-16(14)21-15(23)10-20-17(24)18-7-11-4-12(8-18)6-13(5-11)9-18/h1-3,11-13,22H,4-10H2,(H,20,24)(H,19,21,23)/p+1