3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2,4,5-trimethoxybenzoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2,4,5-trimethoxybenzoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2,4,5-trimethoxybenzoate CAS Name: 2,4,5-trimethoxybenzoic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2,4,5-trimethoxybenzoate Traditional Name: 2,4,5-trimethoxybenzoic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCCN2C3=CC=CC=C3NC2=O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCCN2C3=CC=CC=C3NC2=O)OC)OC

InChI

InChI=1S/C20H22N2O6/c1-25-16-12-18(27-3)17(26-2)11-13(16)19(23)28-10-6-9-22-15-8-5-4-7-14(15)21-20(22)24/h4-5,7-8,11-12H,6,9-10H2,1-3H3,(H,21,24)