ethyl 2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-1H-benzimidazole-4-carboxylate

Systemtic Name: ethyl 2-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-1H-benzimidazole-4-carboxylate Openeye Name: ethyl 2-[(1,3-dioxoisoindolin-2-yl)methyl]-1H-benzimidazole-4-carboxylate CAS Name: 2-[(1,3-dioxo-2-isoindolyl)methyl]-1H-benzimidazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1,3-dioxoisoindol-2-yl)methyl]-1H-benzimidazole-4-carboxylate Traditional Name: 2-(phthalimidomethyl)-1H-benzimidazole-4-carboxylic acid ethyl ester Formula: C19H15N3O4 MolecularWeight: 349.3401

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=CC=C1)NC(=N2)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=C2C(=CC=C1)NC(=N2)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H15N3O4/c1-2-26-19(25)13-8-5-9-14-16(13)21-15(20-14)10-22-17(23)11-6-3-4-7-12(11)18(22)24/h3-9H,2,10H2,1H3,(H,20,21)