4-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzoic acid

Systemtic Name: 4-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzoic acid Openeye Name: 4-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzoic acid CAS Name: 4-[[2-(4-ethoxyphenyl)-1-pyrrolidinyl]sulfonyl]benzoic acid IUPAC Name: 4-[2-(4-ethoxyphenyl)pyrrolidin-1-yl]sulfonylbenzoic acid Traditional Name: 4-(2-p-phenetylpyrrolidino)sulfonylbenzoic acid Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H21NO5S/c1-2-25-16-9-5-14(6-10-16)18-4-3-13-20(18)26(23,24)17-11-7-15(8-12-17)19(21)22/h5-12,18H,2-4,13H2,1H3,(H,21,22)