[(E)-4-(2-oxidanyl-6-oxidanylidene-piperidin-1-yl)but-2-enyl] benzoate

Systemtic Name: [(E)-4-(2-oxidanyl-6-oxidanylidene-piperidin-1-yl)but-2-enyl] benzoate Openeye Name: [(E)-4-(2-hydroxy-6-oxo-1-piperidyl)but-2-enyl] benzoate CAS Name: benzoic acid [(E)-4-(2-hydroxy-6-oxo-1-piperidinyl)but-2-enyl] ester IUPAC Name: [(E)-4-(2-hydroxy-6-oxopiperidin-1-yl)but-2-enyl] benzoate Traditional Name: benzoic acid [(E)-4-(2-hydroxy-6-keto-piperidino)but-2-enyl] ester Formula: C16H19NO4 MolecularWeight: 289.32636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C(=O)C1)CC=CCOC(=O)C2=CC=CC=C2)O

Isomeric SMILES

C1CC(N(C(=O)C1)C/C=C/COC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C16H19NO4/c18-14-9-6-10-15(19)17(14)11-4-5-12-21-16(20)13-7-2-1-3-8-13/h1-5,7-8,14,18H,6,9-12H2/b5-4+