N-(2-methoxy-5-nitro-phenyl)-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxamide CAS Name: N-(2-methoxy-5-nitrophenyl)-1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolecarboxamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxamide Traditional Name: 1,3-diketo-N-(2-methoxy-5-nitro-phenyl)-2-(tetrahydrofurfuryl)isoindoline-5-carboxamide Formula: C21H19N3O7 MolecularWeight: 425.39146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4CCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4CCCO4

InChI

InChI=1S/C21H19N3O7/c1-30-18-7-5-13(24(28)29)10-17(18)22-19(25)12-4-6-15-16(9-12)21(27)23(20(15)26)11-14-3-2-8-31-14/h4-7,9-10,14H,2-3,8,11H2,1H3,(H,22,25)