(E)-6-methoxy-6-oxidanylidene-3-[(2S)-piperidin-2-yl]hex-3-enoic acid

Systemtic Name: (E)-6-methoxy-6-oxidanylidene-3-[(2S)-piperidin-2-yl]hex-3-enoic acid Openeye Name: (E)-6-methoxy-6-oxo-3-[(2S)-2-piperidyl]hex-3-enoic acid CAS Name: (E)-6-methoxy-6-oxo-3-[(2S)-2-piperidinyl]-3-hexenoic acid IUPAC Name: (E)-6-methoxy-6-oxo-3-[(2S)-piperidin-2-yl]hex-3-enoic acid Traditional Name: (E)-6-keto-6-methoxy-3-[(2S)-2-piperidyl]hex-3-enoic acid Formula: C12H19NO4 MolecularWeight: 241.28356

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC=C(CC(=O)O)C1CCCCN1

Isomeric SMILES

COC(=O)C/C=C(\CC(=O)O)/[C@@H]1CCCCN1

InChI

InChI=1S/C12H19NO4/c1-17-12(16)6-5-9(8-11(14)15)10-4-2-3-7-13-10/h5,10,13H,2-4,6-8H2,1H3,(H,14,15)/b9-5+/t10-/m0/s1