N-heptan-2-yl-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide

Systemtic Name: N-heptan-2-yl-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Openeye Name: N-(1-methylhexyl)-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxamide CAS Name: N-heptan-2-yl-1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolecarboxamide IUPAC Name: N-heptan-2-yl-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-N-(1-methylhexyl)-2-(tetrahydrofurfuryl)isoindoline-5-carboxamide Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3CCCO3

Isomeric SMILES

CCCCCC(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3CCCO3

InChI

InChI=1S/C21H28N2O4/c1-3-4-5-7-14(2)22-19(24)15-9-10-17-18(12-15)21(26)23(20(17)25)13-16-8-6-11-27-16/h9-10,12,14,16H,3-8,11,13H2,1-2H3,(H,22,24)