tert-butyl 4-(1-ethoxy-2-methyl-1-oxidanylidene-propan-2-yl)-1H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 4-(1-ethoxy-2-methyl-1-oxidanylidene-propan-2-yl)-1H-pyrrole-2-carboxylate Openeye Name: tert-butyl 4-(2-ethoxy-1,1-dimethyl-2-oxo-ethyl)-1H-pyrrole-2-carboxylate CAS Name: 4-(1-ethoxy-2-methyl-1-oxopropan-2-yl)-1H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-ethoxy-2-methyl-1-oxopropan-2-yl)-1H-pyrrole-2-carboxylate Traditional Name: 4-(2-ethoxy-2-keto-1,1-dimethyl-ethyl)-1H-pyrrole-2-carboxylic acid tert-butyl ester Formula: C15H23NO4 MolecularWeight: 281.34742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)C1=CNC(=C1)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(C)(C)C1=CNC(=C1)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H23NO4/c1-7-19-13(18)15(5,6)10-8-11(16-9-10)12(17)20-14(2,3)4/h8-9,16H,7H2,1-6H3