O4-[(2S)-3,3-dimethylbutan-2-yl] O2-propyl 3-methyl-1H-pyrrole-2,4-dicarboxylate

Systemtic Name: O4-[(2S)-3,3-dimethylbutan-2-yl] O2-propyl 3-methyl-1H-pyrrole-2,4-dicarboxylate Openeye Name: O2-propyl O4-[(1S)-1,2,2-trimethylpropyl] 3-methyl-1H-pyrrole-2,4-dicarboxylate CAS Name: 3-methyl-1H-pyrrole-2,4-dicarboxylic acid O4-[(2S)-3,3-dimethylbutan-2-yl] ester O2-propyl ester IUPAC Name: 4-O-[(2S)-3,3-dimethylbutan-2-yl] 2-O-propyl 3-methyl-1H-pyrrole-2,4-dicarboxylate Traditional Name: 3-methyl-1H-pyrrole-2,4-dicarboxylic acid O2-propyl ester O4-[(1S)-1,2,2-trimethylpropyl] ester Formula: C16H25NO4 MolecularWeight: 295.374

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C(=CN1)C(=O)OC(C)C(C)(C)C)C

Isomeric SMILES

CCCOC(=O)C1=C(C(=CN1)C(=O)O[C@@H](C)C(C)(C)C)C

InChI

InChI=1S/C16H25NO4/c1-7-8-20-15(19)13-10(2)12(9-17-13)14(18)21-11(3)16(4,5)6/h9,11,17H,7-8H2,1-6H3/t11-/m0/s1