N-(4-bromophenyl)-2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(4-bromophenyl)-2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(4-bromophenyl)-2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(4-bromophenyl)-2-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-ium-1-yl]acetamide Formula: C20H22BrN2O3+ MolecularWeight: 418.30428

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC(=O)NC2=CC=C(C=C2)Br)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC(=O)NC2=CC=C(C=C2)Br)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H21BrN2O3/c21-15-4-6-16(7-5-15)22-20(24)13-23-9-1-2-17(23)14-3-8-18-19(12-14)26-11-10-25-18/h3-8,12,17H,1-2,9-11,13H2,(H,22,24)/p+1/t17-/m1/s1