(E)-6-(3-carbamothioyl-7-oxabicyclo[2.2.1]heptan-2-yl)hex-4-enoic acid

Systemtic Name: (E)-6-(3-carbamothioyl-7-oxabicyclo[2.2.1]heptan-2-yl)hex-4-enoic acid Openeye Name: (E)-6-(3-carbamothioyl-7-oxabicyclo[2.2.1]heptan-2-yl)hex-4-enoic acid CAS Name: (E)-6-(3-carbamothioyl-7-oxabicyclo[2.2.1]heptan-2-yl)-4-hexenoic acid IUPAC Name: (E)-6-(3-carbamothioyl-7-oxabicyclo[2.2.1]heptan-2-yl)hex-4-enoic acid Traditional Name: (E)-6-(3-thiocarbamoyl-7-oxabicyclo[2.2.1]heptan-2-yl)hex-4-enoic acid Formula: C13H19NO3S MolecularWeight: 269.35986

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C(C1O2)CC=CCCC(=O)O)C(=S)N

Isomeric SMILES

C1CC2C(C(C1O2)C/C=C/CCC(=O)O)C(=S)N

InChI

InChI=1S/C13H19NO3S/c14-13(18)12-8(9-6-7-10(12)17-9)4-2-1-3-5-11(15)16/h1-2,8-10,12H,3-7H2,(H2,14,18)(H,15,16)/b2-1+