[2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-(1,2-benzoxazol-3-yl)ethanoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-(1,2-benzoxazol-3-yl)ethanoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 2-(1,2-benzoxazol-3-yl)acetate CAS Name: 2-(1,2-benzoxazol-3-yl)acetic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 2-(1,2-benzoxazol-3-yl)acetate Traditional Name: 2-indoxazen-3-ylacetic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)CC4=NOC5=CC=CC=C54

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)CC4=NOC5=CC=CC=C54

InChI

InChI=1S/C21H23NO4/c23-19(21-9-13-5-14(10-21)7-15(6-13)11-21)12-25-20(24)8-17-16-3-1-2-4-18(16)26-22-17/h1-4,13-15H,5-12H2