ethyl 4-(3-oxidanylpentan-3-yl)-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-(3-oxidanylpentan-3-yl)-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(1-ethyl-1-hydroxy-propyl)-1H-pyrrole-3-carboxylate CAS Name: 4-(3-hydroxypentan-3-yl)-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-hydroxypentan-3-yl)-1H-pyrrole-3-carboxylate Traditional Name: 4-(1-ethyl-1-hydroxy-propyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C12H19NO3 MolecularWeight: 225.28416

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CNC=C1C(=O)OCC)O

Isomeric SMILES

CCC(CC)(C1=CNC=C1C(=O)OCC)O

InChI

InChI=1S/C12H19NO3/c1-4-12(15,5-2)10-8-13-7-9(10)11(14)16-6-3/h7-8,13,15H,4-6H2,1-3H3