tert-butyl 4-(2-methyl-3-oxidanylidene-1H-isoindol-5-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-methyl-3-oxidanylidene-1H-isoindol-5-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-methyl-3-oxo-isoindolin-5-yl)piperazine-1-carboxylate CAS Name: 4-(2-methyl-3-oxo-1H-isoindol-5-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-methyl-3-oxo-1H-isoindol-5-yl)piperazine-1-carboxylate Traditional Name: 4-(3-keto-2-methyl-isoindolin-5-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC3=C(CN(C3=O)C)C=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC3=C(CN(C3=O)C)C=C2

InChI

InChI=1S/C18H25N3O3/c1-18(2,3)24-17(23)21-9-7-20(8-10-21)14-6-5-13-12-19(4)16(22)15(13)11-14/h5-6,11H,7-10,12H2,1-4H3