ethyl (3aR,8bR)-2-ethyl-3a,8b-bis(oxidanyl)-4-oxidanylidene-3H-indeno[1,2-b]pyrrole-3-carboxylate

Systemtic Name: ethyl (3aR,8bR)-2-ethyl-3a,8b-bis(oxidanyl)-4-oxidanylidene-3H-indeno[1,2-b]pyrrole-3-carboxylate Openeye Name: ethyl (3aR,8bR)-2-ethyl-3a,8b-dihydroxy-4-oxo-3H-indeno[1,2-b]pyrrole-3-carboxylate CAS Name: (3aR,8bR)-2-ethyl-3a,8b-dihydroxy-4-oxo-3H-indeno[1,2-b]pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (3aR,8bR)-2-ethyl-3a,8b-dihydroxy-4-oxo-3H-indeno[1,2-b]pyrrole-3-carboxylate Traditional Name: (3aR,8bR)-2-ethyl-3a,8b-dihydroxy-4-keto-3H-indeno[1,2-b]pyrrole-3-carboxylic acid ethyl ester Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2(C3=CC=CC=C3C(=O)C2(C1C(=O)OCC)O)O

Isomeric SMILES

CCC1=N[C@]2(C3=CC=CC=C3C(=O)[C@]2(C1C(=O)OCC)O)O

InChI

InChI=1S/C16H17NO5/c1-3-11-12(14(19)22-4-2)15(20)13(18)9-7-5-6-8-10(9)16(15,21)17-11/h5-8,12,20-21H,3-4H2,1-2H3/t12?,15-,16+/m0/s1