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

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 2H-chromene-3-carboxylate CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 2H-chromene-3-carboxylate Traditional Name: 2H-chromene-3-carboxylic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO4/c24-20(23-22-9-14-5-15(10-22)7-16(6-14)11-22)13-27-21(25)18-8-17-3-1-2-4-19(17)26-12-18/h1-4,8,14-16H,5-7,9-13H2,(H,23,24)