methyl (1R,3S)-3-(4-azidophenyl)carbonyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: methyl (1R,3S)-3-(4-azidophenyl)carbonyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: methyl (1R,3S)-3-(4-azidobenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: (1R,3S)-3-[(4-azidophenyl)-oxomethoxy]-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester IUPAC Name: methyl (1R,3S)-3-(4-azidobenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: (1R,3S)-3-(4-azidobenzoyl)oxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCC1C(C(C2)OC(=O)C3=CC=C(C=C3)N=[N+]=[N-])C(=O)OC

Isomeric SMILES

CN1[C@@H]2CCC1C([C@H](C2)OC(=O)C3=CC=C(C=C3)N=[N+]=[N-])C(=O)OC

InChI

InChI=1S/C17H20N4O4/c1-21-12-7-8-13(21)15(17(23)24-2)14(9-12)25-16(22)10-3-5-11(6-4-10)19-20-18/h3-6,12-15H,7-9H2,1-2H3/t12-,13?,14+,15?/m1/s1