(phenylmethyl) (2S)-2-[(E,3Z)-3-hydroxyiminobut-1-enyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) (2S)-2-[(E,3Z)-3-hydroxyiminobut-1-enyl]pyrrolidine-1-carboxylate Openeye Name: benzyl (2S)-2-[(E,3Z)-3-hydroxyiminobut-1-enyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(E,3Z)-3-hydroxyiminobut-1-enyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[(E,3Z)-3-hydroxyiminobut-1-enyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(E,3Z)-3-hydroximinobut-1-enyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NO)C=CC1CCCN1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C/C(=N/O)/C=C/[C@@H]1CCCN1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H20N2O3/c1-13(17-20)9-10-15-8-5-11-18(15)16(19)21-12-14-6-3-2-4-7-14/h2-4,6-7,9-10,15,20H,5,8,11-12H2,1H3/b10-9+,17-13-/t15-/m0/s1