dimethyl (3S,7R)-1,2-oxazepane-3,7-dicarboxylate

Systemtic Name: dimethyl (3S,7R)-1,2-oxazepane-3,7-dicarboxylate Openeye Name: dimethyl (3S,7R)-oxazepane-3,7-dicarboxylate CAS Name: (3S,7R)-oxazepane-3,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (3S,7R)-oxazepane-3,7-dicarboxylate Traditional Name: (3S,7R)-oxazepane-3,7-dicarboxylic acid dimethyl ester Formula: C9H15NO5 MolecularWeight: 217.2191

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCC(ON1)C(=O)OC

Isomeric SMILES

COC(=O)[C@@H]1CCC[C@@H](ON1)C(=O)OC

InChI

InChI=1S/C9H15NO5/c1-13-8(11)6-4-3-5-7(15-10-6)9(12)14-2/h6-7,10H,3-5H2,1-2H3/t6-,7+/m0/s1