propyl 4-(3,3-dimethyl-2-oxidanyl-butanoyl)-3-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: propyl 4-(3,3-dimethyl-2-oxidanyl-butanoyl)-3-methyl-1H-pyrrole-2-carboxylate Openeye Name: propyl 4-(2-hydroxy-3,3-dimethyl-butanoyl)-3-methyl-1H-pyrrole-2-carboxylate CAS Name: 4-(2-hydroxy-3,3-dimethyl-1-oxobutyl)-3-methyl-1H-pyrrole-2-carboxylic acid propyl ester IUPAC Name: propyl 4-(2-hydroxy-3,3-dimethylbutanoyl)-3-methyl-1H-pyrrole-2-carboxylate Traditional Name: 4-(2-hydroxy-3,3-dimethyl-butanoyl)-3-methyl-1H-pyrrole-2-carboxylic acid propyl ester Formula: C15H23NO4 MolecularWeight: 281.34742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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