methyl (5R,6R,7S,8R)-6-oxidanyl-9-oxidanylidene-5-phenethyl-8-phenoxy-1-azabicyclo[5.2.0]nonane-5-carboxylate

Systemtic Name: methyl (5R,6R,7S,8R)-6-oxidanyl-9-oxidanylidene-5-phenethyl-8-phenoxy-1-azabicyclo[5.2.0]nonane-5-carboxylate Openeye Name: methyl (5R,6R,7S,8R)-6-hydroxy-9-oxo-5-phenethyl-8-phenoxy-1-azabicyclo[5.2.0]nonane-5-carboxylate CAS Name: (5R,6R,7S,8R)-6-hydroxy-9-oxo-5-phenethyl-8-phenoxy-1-azabicyclo[5.2.0]nonane-5-carboxylic acid methyl ester IUPAC Name: methyl (5R,6R,7S,8R)-6-hydroxy-9-oxo-5-phenethyl-8-phenoxy-1-azabicyclo[5.2.0]nonane-5-carboxylate Traditional Name: (5R,6R,7S,8R)-6-hydroxy-9-keto-5-phenethyl-8-phenoxy-1-azabicyclo[5.2.0]nonane-5-carboxylic acid methyl ester Formula: C24H27NO5 MolecularWeight: 409.47488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCN2C(C1O)C(C2=O)OC3=CC=CC=C3)CCC4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@@]1(CCCN2[C@@H]([C@@H]1O)[C@H](C2=O)OC3=CC=CC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C24H27NO5/c1-29-23(28)24(15-13-17-9-4-2-5-10-17)14-8-16-25-19(21(24)26)20(22(25)27)30-18-11-6-3-7-12-18/h2-7,9-12,19-21,26H,8,13-16H2,1H3/t19-,20-,21+,24+/m1/s1