2-dimethylaminoethyl 4-methylsulfonylbenzoate

Systemtic Name: 2-dimethylaminoethyl 4-methylsulfonylbenzoate Openeye Name: 2-dimethylaminoethyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid 2-dimethylaminoethyl ester Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)C

Isomeric SMILES

CN(C)CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)C

InChI

InChI=1S/C12H17NO4S/c1-13(2)8-9-17-12(14)10-4-6-11(7-5-10)18(3,15)16/h4-7H,8-9H2,1-3H3