O1-tert-butyl O3a-methyl (3aS,5S,6R)-6-methyl-5-oxidanyl-3,4,5,6-tetrahydro-2H-indole-1,3a-dicarboxylate

Systemtic Name: O1-tert-butyl O3a-methyl (3aS,5S,6R)-6-methyl-5-oxidanyl-3,4,5,6-tetrahydro-2H-indole-1,3a-dicarboxylate Openeye Name: O1-tert-butyl O3a-methyl (3aS,5S,6R)-5-hydroxy-6-methyl-3,4,5,6-tetrahydro-2H-indole-1,3a-dicarboxylate CAS Name: (3aS,5S,6R)-5-hydroxy-6-methyl-3,4,5,6-tetrahydro-2H-indole-1,3a-dicarboxylic acid O1-tert-butyl ester O3a-methyl ester IUPAC Name: 1-O-tert-butyl 3a-O-methyl (3aS,5S,6R)-5-hydroxy-6-methyl-3,4,5,6-tetrahydro-2H-indole-1,3a-dicarboxylate Traditional Name: (3aS,5S,6R)-5-hydroxy-6-methyl-3,4,5,6-tetrahydro-2H-indole-1,3a-dicarboxylic acid O1-tert-butyl ester O3a-methyl ester Formula: C16H25NO5 MolecularWeight: 311.3734

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C2C(CCN2C(=O)OC(C)(C)C)(CC1O)C(=O)OC

Isomeric SMILES

C[C@@H]1C=C2[C@](CCN2C(=O)OC(C)(C)C)(C[C@@H]1O)C(=O)OC

InChI

InChI=1S/C16H25NO5/c1-10-8-12-16(9-11(10)18,13(19)21-5)6-7-17(12)14(20)22-15(2,3)4/h8,10-11,18H,6-7,9H2,1-5H3/t10-,11+,16+/m1/s1