tert-butyl 4-(3-acetyloxypropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 4-(3-acetyloxypropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: tert-butyl 4-(3-acetoxypropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-(3-acetyloxypropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-acetyloxypropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(3-acetoxypropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid tert-butyl ester Formula: C16H25NO4 MolecularWeight: 295.374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CCCOC(=O)C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(NC(=C1CCCOC(=O)C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H25NO4/c1-10-13(8-7-9-20-12(3)18)11(2)17-14(10)15(19)21-16(4,5)6/h17H,7-9H2,1-6H3