3-(2-diethylaminoethylsulfonyl)-4-methoxy-benzoic acid

Systemtic Name: 3-(2-diethylaminoethylsulfonyl)-4-methoxy-benzoic acid Openeye Name: 3-(2-diethylaminoethylsulfonyl)-4-methoxy-benzoic acid CAS Name: 3-(2-diethylaminoethylsulfonyl)-4-methoxybenzoic acid IUPAC Name: 3-(2-diethylaminoethylsulfonyl)-4-methoxybenzoic acid Traditional Name: 3-(2-diethylaminoethylsulfonyl)-4-methoxy-benzoic acid Formula: C14H21NO5S MolecularWeight: 315.38524

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)OC

Isomeric SMILES

CCN(CC)CCS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)OC

InChI

InChI=1S/C14H21NO5S/c1-4-15(5-2)8-9-21(18,19)13-10-11(14(16)17)6-7-12(13)20-3/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,17)