N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C17H19N2O3S+ MolecularWeight: 331.40936

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH2+]C1)C2=CC=C(S2)C(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1C[C@@H]([NH2+]C1)C2=CC=C(S2)C(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C17H18N2O3S/c20-17(16-6-5-15(23-16)12-2-1-7-18-12)19-11-3-4-13-14(10-11)22-9-8-21-13/h3-6,10,12,18H,1-2,7-9H2,(H,19,20)/p+1/t12-/m1/s1