3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-chloranyl-5-methylsulfonyl-benzoate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 2-chloranyl-5-methylsulfonyl-benzoate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-chloro-5-methylsulfonyl-benzoate CAS Name: 2-chloro-5-methylsulfonylbenzoic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 2-chloro-5-methylsulfonylbenzoate Traditional Name: 2-chloro-5-mesyl-benzoic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C18H17ClN2O5S MolecularWeight: 408.85598

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCCCN2C3=CC=CC=C3NC2=O

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCCCN2C3=CC=CC=C3NC2=O

InChI

InChI=1S/C18H17ClN2O5S/c1-27(24,25)12-7-8-14(19)13(11-12)17(22)26-10-4-9-21-16-6-3-2-5-15(16)20-18(21)23/h2-3,5-8,11H,4,9-10H2,1H3,(H,20,23)