[(1S)-2-oxidanylidenecyclohexyl] 3,5-dimethyl-4-[(1S)-1-oxidanylethyl]-1H-pyrrole-2-carboxylate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 3,5-dimethyl-4-[(1S)-1-oxidanylethyl]-1H-pyrrole-2-carboxylate Openeye Name: [(1S)-2-oxocyclohexyl] 4-[(1S)-1-hydroxyethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(1S)-1-hydroxyethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 4-[(1S)-1-hydroxyethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(1S)-1-hydroxyethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid [(1S)-2-ketocyclohexyl] ester Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(C)O)C)C(=O)OC2CCCCC2=O

Isomeric SMILES

CC1=C(NC(=C1[C@H](C)O)C)C(=O)O[C@H]2CCCCC2=O

InChI

InChI=1S/C15H21NO4/c1-8-13(10(3)17)9(2)16-14(8)15(19)20-12-7-5-4-6-11(12)18/h10,12,16-17H,4-7H2,1-3H3/t10-,12-/m0/s1