1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]cyclopentane-1-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]cyclopentane-1-carboxamide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]cyclopentanecarboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-1-cyclopentanecarboxamide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]cyclopentane-1-carboxamide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]cyclopentanecarboxamide Formula: C24H30N3O4+ MolecularWeight: 424.5127

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC3=C(C=C2)OCCO3)C(=O)NCC4=C[NH+]=C(C=C4)N5CCOCC5

Isomeric SMILES

C1CCC(C1)(C2=CC3=C(C=C2)OCCO3)C(=O)NCC4=C[NH+]=C(C=C4)N5CCOCC5

InChI

InChI=1S/C24H29N3O4/c28-23(26-17-18-3-6-22(25-16-18)27-9-11-29-12-10-27)24(7-1-2-8-24)19-4-5-20-21(15-19)31-14-13-30-20/h3-6,15-16H,1-2,7-14,17H2,(H,26,28)/p+1