5-(1,3-benzodioxol-5-yloxymethyl)-N-(4-ethoxy-2-nitro-phenyl)furan-2-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-(4-ethoxy-2-nitro-phenyl)furan-2-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-(4-ethoxy-2-nitro-phenyl)furan-2-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-(4-ethoxy-2-nitrophenyl)-2-furancarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-(4-ethoxy-2-nitrophenyl)furan-2-carboxamide Traditional Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-(4-ethoxy-2-nitro-phenyl)-2-furamide Formula: C21H18N2O8 MolecularWeight: 426.37622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=CC=C(O2)COC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=CC=C(O2)COC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O8/c1-2-27-13-3-6-16(17(9-13)23(25)26)22-21(24)19-8-5-15(31-19)11-28-14-4-7-18-20(10-14)30-12-29-18/h3-10H,2,11-12H2,1H3,(H,22,24)