2-(2,6-dimethylphenoxy)ethyl 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: 2-(2,6-dimethylphenoxy)ethyl 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: 2-(2,6-dimethylphenoxy)ethyl 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid 2-(2,6-dimethylphenoxy)ethyl ester IUPAC Name: 2-(2,6-dimethylphenoxy)ethyl 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid 2-(2,6-dimethylphenoxy)ethyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCOC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCOC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H25NO5S/c1-16-6-5-7-17(2)20(16)26-14-15-27-21(23)18-8-10-19(11-9-18)28(24,25)22-12-3-4-13-22/h5-11H,3-4,12-15H2,1-2H3