(3S)-1-prop-2-ynoylpiperidine-3-carboxylic acid

Systemtic Name: (3S)-1-prop-2-ynoylpiperidine-3-carboxylic acid Openeye Name: (3S)-1-prop-2-ynoylpiperidine-3-carboxylic acid CAS Name: (3S)-1-(1-oxoprop-2-ynyl)-3-piperidinecarboxylic acid IUPAC Name: (3S)-1-prop-2-ynoylpiperidine-3-carboxylic acid Traditional Name: (3S)-1-propioloylnipecotic acid Formula: C9H11NO3 MolecularWeight: 181.18854

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(=O)N1CCCC(C1)C(=O)O

Isomeric SMILES

C#CC(=O)N1CCC[C@@H](C1)C(=O)O

InChI

InChI=1S/C9H11NO3/c1-2-8(11)10-5-3-4-7(6-10)9(12)13/h1,7H,3-6H2,(H,12,13)/t7-/m0/s1