ethyl (3aS,4S,7R,7aS)-7-acetamido-2,2-dimethyl-4-oxidanyl-7,7a-dihydro-3aH-1,3-benzodioxole-4-carboxylate

Systemtic Name: ethyl (3aS,4S,7R,7aS)-7-acetamido-2,2-dimethyl-4-oxidanyl-7,7a-dihydro-3aH-1,3-benzodioxole-4-carboxylate Openeye Name: ethyl (3aS,4S,7R,7aS)-7-acetamido-4-hydroxy-2,2-dimethyl-7,7a-dihydro-3aH-1,3-benzodioxole-4-carboxylate CAS Name: (3aS,4S,7R,7aS)-7-acetamido-4-hydroxy-2,2-dimethyl-7,7a-dihydro-3aH-1,3-benzodioxole-4-carboxylic acid ethyl ester IUPAC Name: ethyl (3aS,4S,7R,7aS)-7-acetamido-4-hydroxy-2,2-dimethyl-7,7a-dihydro-3aH-1,3-benzodioxole-4-carboxylate Traditional Name: (3aS,4S,7R,7aS)-7-acetamido-4-hydroxy-2,2-dimethyl-7,7a-dihydro-3aH-1,3-benzodioxole-4-carboxylic acid ethyl ester Formula: C14H21NO6 MolecularWeight: 299.31964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C=CC(C2C1OC(O2)(C)C)NC(=O)C)O

Isomeric SMILES

CCOC(=O)[C@@]1(C=C[C@H]([C@H]2[C@@H]1OC(O2)(C)C)NC(=O)C)O

InChI

InChI=1S/C14H21NO6/c1-5-19-12(17)14(18)7-6-9(15-8(2)16)10-11(14)21-13(3,4)20-10/h6-7,9-11,18H,5H2,1-4H3,(H,15,16)/t9-,10+,11+,14+/m1/s1