3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]benzoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 3-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]benzoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 3-[(1,3-dioxoisoindolin-2-yl)methyl]benzoate CAS Name: 3-[(1,3-dioxo-2-isoindolyl)methyl]benzoic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 3-[(1,3-dioxoisoindol-2-yl)methyl]benzoate Traditional Name: 3-(phthalimidomethyl)benzoic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C26H21N3O5 MolecularWeight: 455.46204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CC=CC(=C3)C(=O)OCCCN4C5=CC=CC=C5NC4=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CC=CC(=C3)C(=O)OCCCN4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C26H21N3O5/c30-23-19-9-1-2-10-20(19)24(31)29(23)16-17-7-5-8-18(15-17)25(32)34-14-6-13-28-22-12-4-3-11-21(22)27-26(28)33/h1-5,7-12,15H,6,13-14,16H2,(H,27,33)