1-[7-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-oxidanylidene-1,2-dihydroinden-2-yl]-4-ethoxycarbonyl-imidazole-2-carboxylate

Systemtic Name: 1-[7-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-3-oxidanylidene-1,2-dihydroinden-2-yl]-4-ethoxycarbonyl-imidazole-2-carboxylate Openeye Name: 1-[4-[(1,3-dioxoisoindolin-2-yl)methyl]-1-oxo-indan-2-yl]-4-ethoxycarbonyl-imidazole-2-carboxylate CAS Name: 1-[7-[(1,3-dioxo-2-isoindolyl)methyl]-3-oxo-1,2-dihydroinden-2-yl]-4-ethoxycarbonyl-2-imidazolecarboxylate IUPAC Name: 1-[7-[(1,3-dioxoisoindol-2-yl)methyl]-3-oxo-1,2-dihydroinden-2-yl]-4-ethoxycarbonylimidazole-2-carboxylate Traditional Name: 4-carbethoxy-1-[1-keto-4-(phthalimidomethyl)indan-2-yl]imidazole-2-carboxylate Formula: C25H18N3O7- MolecularWeight: 472.42632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C(=N1)C(=O)[O-])C2CC3=C(C2=O)C=CC=C3CN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCOC(=O)C1=CN(C(=N1)C(=O)[O-])C2CC3=C(C2=O)C=CC=C3CN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C25H19N3O7/c1-2-35-25(34)18-12-27(21(26-18)24(32)33)19-10-17-13(6-5-9-14(17)20(19)29)11-28-22(30)15-7-3-4-8-16(15)23(28)31/h3-9,12,19H,2,10-11H2,1H3,(H,32,33)/p-1