3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 3-chloranyl-4,5-dimethoxy-benzoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 3-chloranyl-4,5-dimethoxy-benzoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 3-chloro-4,5-dimethoxy-benzoate CAS Name: 3-chloro-4,5-dimethoxybenzoic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 3-chloro-4,5-dimethoxybenzoate Traditional Name: 3-chloro-4,5-dimethoxy-benzoic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C19H19ClN2O5 MolecularWeight: 390.81756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)OCCCN2C3=CC=CC=C3NC2=O)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)OCCCN2C3=CC=CC=C3NC2=O)Cl)OC

InChI

InChI=1S/C19H19ClN2O5/c1-25-16-11-12(10-13(20)17(16)26-2)18(23)27-9-5-8-22-15-7-4-3-6-14(15)21-19(22)24/h3-4,6-7,10-11H,5,8-9H2,1-2H3,(H,21,24)