[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl] adamantane-2-carboxylate

Systemtic Name: [2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl] adamantane-2-carboxylate Openeye Name: [2-(2-ethylanilino)-2-oxo-ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [2-(2-ethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-ethylanilino)-2-oxoethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [2-(2-ethylanilino)-2-keto-ethyl] ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)COC(=O)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)COC(=O)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C21H27NO3/c1-2-15-5-3-4-6-18(15)22-19(23)12-25-21(24)20-16-8-13-7-14(10-16)11-17(20)9-13/h3-6,13-14,16-17,20H,2,7-12H2,1H3,(H,22,23)