tert-butyl 8-chloranyl-7-methoxy-6-oxidanylidene-1,3,4,10b-tetrahydropyrazino[2,1-a]isoindole-2-carboxylate

Systemtic Name: tert-butyl 8-chloranyl-7-methoxy-6-oxidanylidene-1,3,4,10b-tetrahydropyrazino[2,1-a]isoindole-2-carboxylate Openeye Name: tert-butyl 8-chloro-7-methoxy-6-oxo-1,3,4,10b-tetrahydropyrazino[2,1-a]isoindole-2-carboxylate CAS Name: 8-chloro-7-methoxy-6-oxo-1,3,4,10b-tetrahydropyrazino[2,1-a]isoindole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 8-chloro-7-methoxy-6-oxo-1,3,4,10b-tetrahydropyrazino[2,1-a]isoindole-2-carboxylate Traditional Name: 8-chloro-6-keto-7-methoxy-1,3,4,10b-tetrahydropyrazin[2,1-a]isoindole-2-carboxylic acid tert-butyl ester Formula: C17H21ClN2O4 MolecularWeight: 352.81264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN2C(C1)C3=C(C2=O)C(=C(C=C3)Cl)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN2C(C1)C3=C(C2=O)C(=C(C=C3)Cl)OC

InChI

InChI=1S/C17H21ClN2O4/c1-17(2,3)24-16(22)19-7-8-20-12(9-19)10-5-6-11(18)14(23-4)13(10)15(20)21/h5-6,12H,7-9H2,1-4H3