(6S,7R)-7-tert-butyl-6-(furan-2-yl)azepane-2,4-dione

Systemtic Name: (6S,7R)-7-tert-butyl-6-(furan-2-yl)azepane-2,4-dione Openeye Name: (6S,7R)-7-tert-butyl-6-(2-furyl)azepane-2,4-dione CAS Name: (6S,7R)-7-tert-butyl-6-(2-furanyl)azepane-2,4-dione IUPAC Name: (6S,7R)-7-tert-butyl-6-(furan-2-yl)azepane-2,4-dione Traditional Name: (6S,7R)-7-tert-butyl-6-(2-furyl)azepane-2,4-quinone Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1C(CC(=O)CC(=O)N1)C2=CC=CO2

Isomeric SMILES

CC(C)(C)[C@H]1[C@H](CC(=O)CC(=O)N1)C2=CC=CO2

InChI

InChI=1S/C14H19NO3/c1-14(2,3)13-10(11-5-4-6-18-11)7-9(16)8-12(17)15-13/h4-6,10,13H,7-8H2,1-3H3,(H,15,17)/t10-,13-/m1/s1