ethyl (3R,4R,5S)-4-acetamido-5-azido-3-pentoxy-cyclohexene-1-carboxylate

Systemtic Name: ethyl (3R,4R,5S)-4-acetamido-5-azido-3-pentoxy-cyclohexene-1-carboxylate Openeye Name: ethyl (3R,4R,5S)-4-acetamido-5-azido-3-pentoxy-cyclohexene-1-carboxylate CAS Name: (3R,4R,5S)-4-acetamido-5-azido-3-pentoxy-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl (3R,4R,5S)-4-acetamido-5-azido-3-pentoxycyclohexene-1-carboxylate Traditional Name: (3R,4R,5S)-4-acetamido-3-amoxy-5-azido-cyclohexene-1-carboxylic acid ethyl ester Formula: C16H26N4O4 MolecularWeight: 338.40204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1C=C(CC(C1NC(=O)C)N=[N+]=[N-])C(=O)OCC

Isomeric SMILES

CCCCCO[C@@H]1C=C(C[C@@H]([C@H]1NC(=O)C)N=[N+]=[N-])C(=O)OCC

InChI

InChI=1S/C16H26N4O4/c1-4-6-7-8-24-14-10-12(16(22)23-5-2)9-13(19-20-17)15(14)18-11(3)21/h10,13-15H,4-9H2,1-3H3,(H,18,21)/t13-,14+,15+/m0/s1