4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxymethyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxymethyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: 4-[(2,2-dimethyl-3H-benzofuran-7-yl)oxymethyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide CAS Name: 4-[(2,2-dimethyl-3H-benzofuran-7-yl)oxymethyl]-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 4-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxymethyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: 4-[(2,2-dimethylcoumaran-7-yl)oxymethyl]-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C25H33N2O4+ MolecularWeight: 425.54052

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OCC3=CC=C(C=C3)C(=O)NCCC[NH+]4CCOCC4)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OCC3=CC=C(C=C3)C(=O)NCCC[NH+]4CCOCC4)C

InChI

InChI=1S/C25H32N2O4/c1-25(2)17-21-5-3-6-22(23(21)31-25)30-18-19-7-9-20(10-8-19)24(28)26-11-4-12-27-13-15-29-16-14-27/h3,5-10H,4,11-18H2,1-2H3,(H,26,28)/p+1