2-[3-(1-adamantyl)-1,2-oxazol-5-yl]ethanoic acid

Systemtic Name: 2-[3-(1-adamantyl)-1,2-oxazol-5-yl]ethanoic acid Openeye Name: 2-[3-(1-adamantyl)isoxazol-5-yl]acetic acid CAS Name: 2-[3-(1-adamantyl)-5-isoxazolyl]acetic acid IUPAC Name: 2-[3-(1-adamantyl)-1,2-oxazol-5-yl]acetic acid Traditional Name: 2-[3-(1-adamantyl)isoxazol-5-yl]acetic acid Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NOC(=C4)CC(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NOC(=C4)CC(=O)O

InChI

InChI=1S/C15H19NO3/c17-14(18)5-12-4-13(16-19-12)15-6-9-1-10(7-15)3-11(2-9)8-15/h4,9-11H,1-3,5-8H2,(H,17,18)