1H-benzimidazol-2-yl 2,4-dimethylbenzenesulfonate

Systemtic Name: 1H-benzimidazol-2-yl 2,4-dimethylbenzenesulfonate Openeye Name: 1H-benzimidazol-2-yl 2,4-dimethylbenzenesulfonate CAS Name: 2,4-dimethylbenzenesulfonic acid 1H-benzimidazol-2-yl ester IUPAC Name: 1H-benzimidazol-2-yl 2,4-dimethylbenzenesulfonate Traditional Name: 2,4-dimethylbenzenesulfonic acid 1H-benzimidazol-2-yl ester Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)OC2=NC3=CC=CC=C3N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)OC2=NC3=CC=CC=C3N2)C

InChI

InChI=1S/C15H14N2O3S/c1-10-7-8-14(11(2)9-10)21(18,19)20-15-16-12-5-3-4-6-13(12)17-15/h3-9H,1-2H3,(H,16,17)