5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-ethoxy-benzamide

Systemtic Name: 5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-ethoxy-benzamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-5-[(1,3-dioxoisoindolin-2-yl)methyl]-2-ethoxy-benzamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-5-[(1,3-dioxo-2-isoindolyl)methyl]-2-ethoxybenzamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-5-[(1,3-dioxoisoindol-2-yl)methyl]-2-ethoxybenzamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-ethoxy-5-(phthalimidomethyl)benzamide Formula: C27H22N2O7 MolecularWeight: 486.47278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)NC4=CC5=C(C=C4C(=O)C)OCO5

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)NC4=CC5=C(C=C4C(=O)C)OCO5

InChI

InChI=1S/C27H22N2O7/c1-3-34-22-9-8-16(13-29-26(32)17-6-4-5-7-18(17)27(29)33)10-20(22)25(31)28-21-12-24-23(35-14-36-24)11-19(21)15(2)30/h4-12H,3,13-14H2,1-2H3,(H,28,31)