3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-(2,5-dimethylphenyl)sulfonyloxybenzoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-(2,5-dimethylphenyl)sulfonyloxybenzoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-(2,5-dimethylphenyl)sulfonyloxybenzoate CAS Name: 2-(2,5-dimethylphenyl)sulfonyloxybenzoic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-(2,5-dimethylphenyl)sulfonyloxybenzoate Traditional Name: 2-(2,5-dimethylphenyl)sulfonyloxybenzoic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C25H24N2O6S MolecularWeight: 480.53286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=CC=C2C(=O)OCCCN3C4=CC=CC=C4NC3=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=CC=C2C(=O)OCCCN3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C25H24N2O6S/c1-17-12-13-18(2)23(16-17)34(30,31)33-22-11-6-3-8-19(22)24(28)32-15-7-14-27-21-10-5-4-9-20(21)26-25(27)29/h3-6,8-13,16H,7,14-15H2,1-2H3,(H,26,29)