tert-butyl 4-[4-[1,3-bis(oxidanylidene)isoindol-4-yl]butyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[1,3-bis(oxidanylidene)isoindol-4-yl]butyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(1,3-dioxoisoindolin-4-yl)butyl]piperidine-1-carboxylate CAS Name: 4-[4-(1,3-dioxo-4-isoindolyl)butyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(1,3-dioxoisoindol-4-yl)butyl]piperidine-1-carboxylate Traditional Name: 4-[4-(1,3-diketoisoindolin-4-yl)butyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCCCC2=CC=CC3=C2C(=O)NC3=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCCCC2=CC=CC3=C2C(=O)NC3=O

InChI

InChI=1S/C22H30N2O4/c1-22(2,3)28-21(27)24-13-11-15(12-14-24)7-4-5-8-16-9-6-10-17-18(16)20(26)23-19(17)25/h6,9-10,15H,4-5,7-8,11-14H2,1-3H3,(H,23,25,26)