2,3-dihydro-1,4-benzodioxin-3-ylmethyl 2-(4-oxidanyl-3-pyrrolidin-1-yl-phenyl)ethanoate

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 2-(4-oxidanyl-3-pyrrolidin-1-yl-phenyl)ethanoate Openeye Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 2-(4-hydroxy-3-pyrrolidin-1-yl-phenyl)acetate CAS Name: 2-[4-hydroxy-3-(1-pyrrolidinyl)phenyl]acetic acid 2,3-dihydro-1,4-benzodioxin-3-ylmethyl ester IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-ylmethyl 2-(4-hydroxy-3-pyrrolidin-1-ylphenyl)acetate Traditional Name: 2-(4-hydroxy-3-pyrrolidino-phenyl)acetic acid 2,3-dihydro-1,4-benzodioxin-3-ylmethyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=CC(=C2)CC(=O)OCC3COC4=CC=CC=C4O3)O

Isomeric SMILES

C1CCN(C1)C2=C(C=CC(=C2)CC(=O)OCC3COC4=CC=CC=C4O3)O

InChI

InChI=1S/C21H23NO5/c23-18-8-7-15(11-17(18)22-9-3-4-10-22)12-21(24)26-14-16-13-25-19-5-1-2-6-20(19)27-16/h1-2,5-8,11,16,23H,3-4,9-10,12-14H2