tert-butyl 7-chloranyl-10-oxidanyl-6-oxidanylidene-1,3,4,10b-tetrahydropyrazino[2,1-a]isoindole-2-carboxylate

Systemtic Name: tert-butyl 7-chloranyl-10-oxidanyl-6-oxidanylidene-1,3,4,10b-tetrahydropyrazino[2,1-a]isoindole-2-carboxylate Openeye Name: tert-butyl 7-chloro-10-hydroxy-6-oxo-1,3,4,10b-tetrahydropyrazino[2,1-a]isoindole-2-carboxylate CAS Name: 7-chloro-10-hydroxy-6-oxo-1,3,4,10b-tetrahydropyrazino[2,1-a]isoindole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-chloro-10-hydroxy-6-oxo-1,3,4,10b-tetrahydropyrazino[2,1-a]isoindole-2-carboxylate Traditional Name: 7-chloro-10-hydroxy-6-keto-1,3,4,10b-tetrahydropyrazin[2,1-a]isoindole-2-carboxylic acid tert-butyl ester Formula: C16H19ClN2O4 MolecularWeight: 338.78606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN2C(C1)C3=C(C=CC(=C3C2=O)Cl)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN2C(C1)C3=C(C=CC(=C3C2=O)Cl)O

InChI

InChI=1S/C16H19ClN2O4/c1-16(2,3)23-15(22)18-6-7-19-10(8-18)13-11(20)5-4-9(17)12(13)14(19)21/h4-5,10,20H,6-8H2,1-3H3