[2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] adamantane-2-carboxylate

Systemtic Name: [2-[(2,6-diethylphenyl)amino]-2-oxidanylidene-ethyl] adamantane-2-carboxylate Openeye Name: [2-(2,6-diethylanilino)-2-oxo-ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [2-(2,6-diethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,6-diethylanilino)-2-oxoethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [2-(2,6-diethylanilino)-2-keto-ethyl] ester Formula: C23H31NO3 MolecularWeight: 369.49714

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)COC(=O)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C23H31NO3/c1-3-16-6-5-7-17(4-2)22(16)24-20(25)13-27-23(26)21-18-9-14-8-15(11-18)12-19(21)10-14/h5-7,14-15,18-19,21H,3-4,8-13H2,1-2H3,(H,24,25)