[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] adamantane-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] adamantane-2-carboxylate Openeye Name: [2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] adamantane-2-carboxylate CAS Name: 2-adamantanecarboxylic acid [2-oxo-2-(1,2,5-trimethyl-3-pyrrolyl)ethyl] ester IUPAC Name: [2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] adamantane-2-carboxylate Traditional Name: adamantane-2-carboxylic acid [2-keto-2-(1,2,5-trimethylpyrrol-3-yl)ethyl] ester Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)COC(=O)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)COC(=O)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C20H27NO3/c1-11-4-17(12(2)21(11)3)18(22)10-24-20(23)19-15-6-13-5-14(8-15)9-16(19)7-13/h4,13-16,19H,5-10H2,1-3H3