4-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]butane-1-sulfonic acid

Systemtic Name: 4-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]butane-1-sulfonic acid Openeye Name: 4-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]butane-1-sulfonic acid CAS Name: 4-[(2R)-2-(2,4-dimethoxyphenyl)-1-pyrrolidinyl]-1-butanesulfonic acid IUPAC Name: 4-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-yl]butane-1-sulfonic acid Traditional Name: 4-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidino]butane-1-sulfonic acid Formula: C16H25NO5S MolecularWeight: 343.4384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCCN2CCCCS(=O)(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[C@H]2CCCN2CCCCS(=O)(=O)O)OC

InChI

InChI=1S/C16H25NO5S/c1-21-13-7-8-14(16(12-13)22-2)15-6-5-10-17(15)9-3-4-11-23(18,19)20/h7-8,12,15H,3-6,9-11H2,1-2H3,(H,18,19,20)/t15-/m1/s1