methyl (3R,7aR)-3-tert-butyl-5-oxidanyl-7-oxidanylidene-6-phenyl-1,3-dihydropyrrolo[1,2-c][1,3]oxazole-7a-carboxylate

Systemtic Name: methyl (3R,7aR)-3-tert-butyl-5-oxidanyl-7-oxidanylidene-6-phenyl-1,3-dihydropyrrolo[1,2-c][1,3]oxazole-7a-carboxylate Openeye Name: methyl (3R,7aR)-3-tert-butyl-5-hydroxy-7-oxo-6-phenyl-1,3-dihydropyrrolo[1,2-c]oxazole-7a-carboxylate CAS Name: (3R,7aR)-3-tert-butyl-5-hydroxy-7-oxo-6-phenyl-1,3-dihydropyrrolo[1,2-c]oxazole-7a-carboxylic acid methyl ester IUPAC Name: methyl (3R,7aR)-3-tert-butyl-5-hydroxy-7-oxo-6-phenyl-1,3-dihydropyrrolo[1,2-c][1,3]oxazole-7a-carboxylate Traditional Name: (3R,7aR)-3-tert-butyl-5-hydroxy-7-keto-6-phenyl-1,3-dihydropyrrolo[1,2-c]oxazole-7a-carboxylic acid methyl ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1N2C(=C(C(=O)C2(CO1)C(=O)OC)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)[C@@H]1N2C(=C(C(=O)[C@]2(CO1)C(=O)OC)C3=CC=CC=C3)O

InChI

InChI=1S/C18H21NO5/c1-17(2,3)15-19-14(21)12(11-8-6-5-7-9-11)13(20)18(19,10-24-15)16(22)23-4/h5-9,15,21H,10H2,1-4H3/t15-,18-/m1/s1