2-methoxyethyl (3aS,8bS)-2-methyl-3a,8b-bis(oxidanyl)-4-oxidanylidene-3H-indeno[1,2-b]pyrrole-3-carboxylate

Systemtic Name: 2-methoxyethyl (3aS,8bS)-2-methyl-3a,8b-bis(oxidanyl)-4-oxidanylidene-3H-indeno[1,2-b]pyrrole-3-carboxylate Openeye Name: 2-methoxyethyl (3aS,8bS)-3a,8b-dihydroxy-2-methyl-4-oxo-3H-indeno[1,2-b]pyrrole-3-carboxylate CAS Name: (3aS,8bS)-3a,8b-dihydroxy-2-methyl-4-oxo-3H-indeno[1,2-b]pyrrole-3-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (3aS,8bS)-3a,8b-dihydroxy-2-methyl-4-oxo-3H-indeno[1,2-b]pyrrole-3-carboxylate Traditional Name: (3aS,8bS)-3a,8b-dihydroxy-4-keto-2-methyl-3H-indeno[1,2-b]pyrrole-3-carboxylic acid 2-methoxyethyl ester Formula: C16H17NO6 MolecularWeight: 319.30928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2(C3=CC=CC=C3C(=O)C2(C1C(=O)OCCOC)O)O

Isomeric SMILES

CC1=N[C@@]2(C3=CC=CC=C3C(=O)[C@@]2(C1C(=O)OCCOC)O)O

InChI

InChI=1S/C16H17NO6/c1-9-12(14(19)23-8-7-22-2)15(20)13(18)10-5-3-4-6-11(10)16(15,21)17-9/h3-6,12,20-21H,7-8H2,1-2H3/t12?,15-,16+/m1/s1