2-(1,3-benzodioxol-5-ylmethyl)-N-tert-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-tert-butyl-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-tert-butyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-tert-butyl-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-N-tert-butyl-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-tert-butyl-1,3-diketo-2-piperonyl-isoindoline-5-carboxamide Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H20N2O5/c1-21(2,3)22-18(24)13-5-6-14-15(9-13)20(26)23(19(14)25)10-12-4-7-16-17(8-12)28-11-27-16/h4-9H,10-11H2,1-3H3,(H,22,24)