(1S,6S)-6-[[(2S)-oxolan-2-yl]methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6S)-6-[[(2S)-oxolan-2-yl]methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6S)-6-[[(2S)-tetrahydrofuran-2-yl]methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6S)-6-[oxo-[[(2S)-2-oxolanyl]methylamino]methyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6S)-6-[[(2S)-oxolan-2-yl]methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6S)-6-[[(2S)-tetrahydrofuran-2-yl]methylcarbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2CC=CCC2C(=O)O

Isomeric SMILES

C1C[C@H](OC1)CNC(=O)[C@H]2CC=CC[C@@H]2C(=O)O

InChI

InChI=1S/C13H19NO4/c15-12(14-8-9-4-3-7-18-9)10-5-1-2-6-11(10)13(16)17/h1-2,9-11H,3-8H2,(H,14,15)(H,16,17)/t9-,10-,11-/m0/s1