(phenylmethyl) 2-[(E)-3-oxidanylidenebut-1-enyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[(E)-3-oxidanylidenebut-1-enyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[(E)-3-oxobut-1-enyl]pyrrolidine-1-carboxylate CAS Name: 2-[(E)-3-oxobut-1-enyl]-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(E)-3-oxobut-1-enyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(E)-3-ketobut-1-enyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1CCCN1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)/C=C/C1CCCN1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H19NO3/c1-13(18)9-10-15-8-5-11-17(15)16(19)20-12-14-6-3-2-4-7-14/h2-4,6-7,9-10,15H,5,8,11-12H2,1H3/b10-9+