(1S,6R)-6-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonylcyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6R)-6-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonylcyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6R)-6-[4-(furan-2-carbonyl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6R)-6-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6R)-6-[4-(furan-2-carbonyl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6R)-6-[4-(2-furoyl)piperazine-1-carbonyl]cyclohex-3-ene-1-carboxylic acid Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2CC=CCC2C(=O)O)C(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CCN1C(=O)[C@@H]2CC=CC[C@@H]2C(=O)O)C(=O)C3=CC=CO3

InChI

InChI=1S/C17H20N2O5/c20-15(12-4-1-2-5-13(12)17(22)23)18-7-9-19(10-8-18)16(21)14-6-3-11-24-14/h1-3,6,11-13H,4-5,7-10H2,(H,22,23)/t12-,13+/m1/s1