1-(3-oxidanylidene-3-phenyl-propanethioyl)piperidine-2-carboxylic acid

Systemtic Name: 1-(3-oxidanylidene-3-phenyl-propanethioyl)piperidine-2-carboxylic acid Openeye Name: 1-(3-oxo-3-phenyl-propanethioyl)piperidine-2-carboxylic acid CAS Name: 1-(3-oxo-3-phenyl-1-sulfanylidenepropyl)-2-piperidinecarboxylic acid IUPAC Name: 1-(3-oxo-3-phenylpropanethioyl)piperidine-2-carboxylic acid Traditional Name: 1-(3-keto-3-phenyl-propanethioyl)pipecolinic acid Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(=S)CC(=O)C2=CC=CC=C2

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(=S)CC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H17NO3S/c17-13(11-6-2-1-3-7-11)10-14(20)16-9-5-4-8-12(16)15(18)19/h1-3,6-7,12H,4-5,8-10H2,(H,18,19)