2-[4-(2-dimethylaminoethylsulfonyl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(2-dimethylaminoethylsulfonyl)phenyl]ethanoic acid Openeye Name: 2-[4-(2-dimethylaminoethylsulfonyl)phenyl]acetic acid CAS Name: 2-[4-(2-dimethylaminoethylsulfonyl)phenyl]acetic acid IUPAC Name: 2-[4-(2-dimethylaminoethylsulfonyl)phenyl]acetic acid Traditional Name: 2-[4-(2-dimethylaminoethylsulfonyl)phenyl]acetic acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCS(=O)(=O)C1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CN(C)CCS(=O)(=O)C1=CC=C(C=C1)CC(=O)O

InChI

InChI=1S/C12H17NO4S/c1-13(2)7-8-18(16,17)11-5-3-10(4-6-11)9-12(14)15/h3-6H,7-9H2,1-2H3,(H,14,15)