3-(2-adamantyl)-2-methyl-propanoic acid; 1-oxidanidylpyridin-1-ium

Systemtic Name: 3-(2-adamantyl)-2-methyl-propanoic acid; 1-oxidanidylpyridin-1-ium Openeye Name: 3-(2-adamantyl)-2-methyl-propanoic acid; 1-oxidopyridin-1-ium CAS Name: 3-(2-adamantyl)-2-methylpropanoic acid; 1-oxidopyridin-1-ium IUPAC Name: 3-(2-adamantyl)-2-methylpropanoic acid; 1-oxidopyridin-1-ium Traditional Name: 3-(2-adamantyl)-2-methyl-propionic acid; 1-oxidopyridin-1-ium Formula: C19H27NO3 MolecularWeight: 317.42258

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1C2CC3CC(C2)CC1C3)C(=O)O.C1=CC=[N+](C=C1)[O-]

Isomeric SMILES

CC(CC1C2CC3CC(C2)CC1C3)C(=O)O.C1=CC=[N+](C=C1)[O-]

InChI

InChI=1S/C14H22O2.C5H5NO/c1-8(14(15)16)2-13-11-4-9-3-10(6-11)7-12(13)5-9;7-6-4-2-1-3-5-6/h8-13H,2-7H2,1H3,(H,15,16);1-5H