[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] adamantane-2-carboxylate

Systemtic Name: [2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] adamantane-2-carboxylate Openeye Name: [2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [2-(2-ethyl-6-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-ethyl-6-methylanilino)-2-oxoethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl] ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29NO3/c1-3-16-6-4-5-13(2)21(16)23-19(24)12-26-22(25)20-17-8-14-7-15(10-17)11-18(20)9-14/h4-6,14-15,17-18,20H,3,7-12H2,1-2H3,(H,23,24)