[(1R,2R)-1-azido-3-methoxy-3-oxidanylidene-1-phenyl-propan-2-yl] cyclohexanecarboxylate

Systemtic Name: [(1R,2R)-1-azido-3-methoxy-3-oxidanylidene-1-phenyl-propan-2-yl] cyclohexanecarboxylate Openeye Name: [(1R)-1-[(R)-azido(phenyl)methyl]-2-methoxy-2-oxo-ethyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [(1R,2R)-1-azido-3-methoxy-3-oxo-1-phenylpropan-2-yl] ester IUPAC Name: [(1R,2R)-1-azido-3-methoxy-3-oxo-1-phenylpropan-2-yl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [(1R)-1-[(R)-azido(phenyl)methyl]-2-keto-2-methoxy-ethyl] ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C1=CC=CC=C1)N=[N+]=[N-])OC(=O)C2CCCCC2

Isomeric SMILES

COC(=O)[C@@H]([C@@H](C1=CC=CC=C1)N=[N+]=[N-])OC(=O)C2CCCCC2

InChI

InChI=1S/C17H21N3O4/c1-23-17(22)15(24-16(21)13-10-6-3-7-11-13)14(19-20-18)12-8-4-2-5-9-12/h2,4-5,8-9,13-15H,3,6-7,10-11H2,1H3/t14-,15-/m1/s1