O2-[2-(1-adamantyl)-2-oxidanylidene-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O2-[2-(1-adamantyl)-2-oxidanylidene-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-[2-(1-adamantyl)-2-oxo-ethyl] O4-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(1-adamantyl)-2-oxoethyl] ester O4-methyl ester IUPAC Name: 2-O-[2-(1-adamantyl)-2-oxoethyl] 4-O-methyl 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 5-ethyl-3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-[2-(1-adamantyl)-2-keto-ethyl] ester O4-methyl ester Formula: C22H29NO5 MolecularWeight: 387.46936

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)OCC(=O)C23CC4CC(C2)CC(C4)C3)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)OCC(=O)C23CC4CC(C2)CC(C4)C3)C)C(=O)OC

InChI

InChI=1S/C22H29NO5/c1-4-16-18(20(25)27-3)12(2)19(23-16)21(26)28-11-17(24)22-8-13-5-14(9-22)7-15(6-13)10-22/h13-15,23H,4-11H2,1-3H3