(1S,6S)-6-[(2S)-2-methylmorpholin-4-yl]carbonylcyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6S)-6-[(2S)-2-methylmorpholin-4-yl]carbonylcyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6S)-6-[(2S)-2-methylmorpholine-4-carbonyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6S)-6-[[(2S)-2-methyl-4-morpholinyl]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6S)-6-[(2S)-2-methylmorpholine-4-carbonyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6S)-6-[(2S)-2-methylmorpholine-4-carbonyl]cyclohex-3-ene-1-carboxylic acid Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)C(=O)C2CC=CCC2C(=O)O

Isomeric SMILES

C[C@H]1CN(CCO1)C(=O)[C@H]2CC=CC[C@@H]2C(=O)O

InChI

InChI=1S/C13H19NO4/c1-9-8-14(6-7-18-9)12(15)10-4-2-3-5-11(10)13(16)17/h2-3,9-11H,4-8H2,1H3,(H,16,17)/t9-,10-,11-/m0/s1