ethyl 4-[2-(1-adamantylcarbonyloxy)ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-(1-adamantylcarbonyloxy)ethanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-(adamantane-1-carbonyloxy)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-[1-adamantyl(oxo)methoxy]-1-oxoethyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(adamantane-1-carbonyloxy)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-(adamantane-1-carbonyloxy)acetyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H29NO5 MolecularWeight: 387.46936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)C23CC4CC(C2)CC(C4)C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)COC(=O)C23CC4CC(C2)CC(C4)C3)C)C

InChI

InChI=1S/C22H29NO5/c1-4-27-20(25)19-13(3)23-12(2)18(19)17(24)11-28-21(26)22-8-14-5-15(9-22)7-16(6-14)10-22/h14-16,23H,4-11H2,1-3H3