[2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] adamantane-1-carboxylate

Systemtic Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] adamantane-1-carboxylate Openeye Name: [2-(chroman-4-ylamino)-2-oxo-ethyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-(3,4-dihydro-2H-1-benzopyran-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxoethyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [2-(chroman-4-ylamino)-2-keto-ethyl] ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2C1NC(=O)COC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1COC2=CC=CC=C2C1NC(=O)COC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27NO4/c24-20(23-18-5-6-26-19-4-2-1-3-17(18)19)13-27-21(25)22-10-14-7-15(11-22)9-16(8-14)12-22/h1-4,14-16,18H,5-13H2,(H,23,24)