[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-oxidanylidenechromene-3-carboxylate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C22H23NO5 MolecularWeight: 381.42172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)COC(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C22H23NO5/c24-19(23-22-9-13-5-14(10-22)7-15(6-13)11-22)12-27-20(25)17-8-16-3-1-2-4-18(16)28-21(17)26/h1-4,8,13-15H,5-7,9-12H2,(H,23,24)