O1-(1-adamantyl) O3-cyclohexyl 3-(2-methylpropyl)-2H-pyrrole-1,3-dicarboxylate

Systemtic Name: O1-(1-adamantyl) O3-cyclohexyl 3-(2-methylpropyl)-2H-pyrrole-1,3-dicarboxylate Openeye Name: O1-(1-adamantyl) O3-cyclohexyl 3-isobutyl-2H-pyrrole-1,3-dicarboxylate CAS Name: 3-(2-methylpropyl)-2H-pyrrole-1,3-dicarboxylic acid O1-(1-adamantyl) ester O3-cyclohexyl ester IUPAC Name: 1-O-(1-adamantyl) 3-O-cyclohexyl 3-(2-methylpropyl)-2H-pyrrole-1,3-dicarboxylate Traditional Name: 3-isobutyl-2-pyrroline-1,3-dicarboxylic acid O1-(1-adamantyl) ester O3-cyclohexyl ester Formula: C26H39NO4 MolecularWeight: 429.59216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CN(C=C1)C(=O)OC23CC4CC(C2)CC(C4)C3)C(=O)OC5CCCCC5

Isomeric SMILES

CC(C)CC1(CN(C=C1)C(=O)OC23CC4CC(C2)CC(C4)C3)C(=O)OC5CCCCC5

InChI

InChI=1S/C26H39NO4/c1-18(2)13-25(23(28)30-22-6-4-3-5-7-22)8-9-27(17-25)24(29)31-26-14-19-10-20(15-26)12-21(11-19)16-26/h8-9,18-22H,3-7,10-17H2,1-2H3