2-[2-(2-dimethylaminoethyloxy)ethylsulfonyl-phenyl-methyl]benzenesulfinic acid

Systemtic Name: 2-[2-(2-dimethylaminoethyloxy)ethylsulfonyl-phenyl-methyl]benzenesulfinic acid Openeye Name: 2-[2-(2-dimethylaminoethyloxy)ethylsulfonyl-phenyl-methyl]benzenesulfinic acid CAS Name: 2-[2-(2-dimethylaminoethyloxy)ethylsulfonyl-phenylmethyl]benzenesulfinic acid IUPAC Name: 2-[2-(2-dimethylaminoethyloxy)ethylsulfonyl-phenylmethyl]benzenesulfinic acid Traditional Name: 2-[2-(2-dimethylaminoethyloxy)ethylsulfonyl-phenyl-methyl]benzenesulfinic acid Formula: C19H25NO5S2 MolecularWeight: 411.5355

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOCCS(=O)(=O)C(C1=CC=CC=C1)C2=CC=CC=C2S(=O)O

Isomeric SMILES

CN(C)CCOCCS(=O)(=O)C(C1=CC=CC=C1)C2=CC=CC=C2S(=O)O

InChI

InChI=1S/C19H25NO5S2/c1-20(2)12-13-25-14-15-27(23,24)19(16-8-4-3-5-9-16)17-10-6-7-11-18(17)26(21)22/h3-11,19H,12-15H2,1-2H3,(H,21,22)