[(3S)-1-(phenylmethyl)pyrrolidin-3-yl] 3-oxidanylidenebutanoate

Systemtic Name: [(3S)-1-(phenylmethyl)pyrrolidin-3-yl] 3-oxidanylidenebutanoate Openeye Name: [(3S)-1-benzylpyrrolidin-3-yl] 3-oxobutanoate CAS Name: 3-oxobutanoic acid [(3S)-1-(phenylmethyl)-3-pyrrolidinyl] ester IUPAC Name: [(3S)-1-benzylpyrrolidin-3-yl] 3-oxobutanoate Traditional Name: 3-ketobutyric acid [(3S)-1-benzylpyrrolidin-3-yl] ester Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OC1CCN(C1)CC2=CC=CC=C2

Isomeric SMILES

CC(=O)CC(=O)O[C@H]1CCN(C1)CC2=CC=CC=C2

InChI

InChI=1S/C15H19NO3/c1-12(17)9-15(18)19-14-7-8-16(11-14)10-13-5-3-2-4-6-13/h2-6,14H,7-11H2,1H3/t14-/m0/s1