N-(3-imidazol-1-ylpropyl)-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-1,3-diketo-2-(tetrahydrofurfuryl)isoindoline-5-carboxamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C20H22N4O4/c25-18(22-6-2-8-23-9-7-21-13-23)14-4-5-16-17(11-14)20(27)24(19(16)26)12-15-3-1-10-28-15/h4-5,7,9,11,13,15H,1-3,6,8,10,12H2,(H,22,25)