tert-butyl 3,4-dimethyl-5-[(E)-(5-oxidanylideneoxolan-2-ylidene)methyl]-1H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 3,4-dimethyl-5-[(E)-(5-oxidanylideneoxolan-2-ylidene)methyl]-1H-pyrrole-2-carboxylate Openeye Name: tert-butyl 3,4-dimethyl-5-[(E)-(5-oxotetrahydrofuran-2-ylidene)methyl]-1H-pyrrole-2-carboxylate CAS Name: 3,4-dimethyl-5-[(E)-(5-oxo-2-oxolanylidene)methyl]-1H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3,4-dimethyl-5-[(E)-(5-oxooxolan-2-ylidene)methyl]-1H-pyrrole-2-carboxylate Traditional Name: 5-[(E)-(5-ketotetrahydrofuran-2-ylidene)methyl]-3,4-dimethyl-1H-pyrrole-2-carboxylic acid tert-butyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C)C(=O)OC(C)(C)C)C=C2CCC(=O)O2

Isomeric SMILES

CC1=C(NC(=C1C)C(=O)OC(C)(C)C)/C=C/2\CCC(=O)O2

InChI

InChI=1S/C16H21NO4/c1-9-10(2)14(15(19)21-16(3,4)5)17-12(9)8-11-6-7-13(18)20-11/h8,17H,6-7H2,1-5H3/b11-8+