N-(2,6-diethylphenyl)-2-methyl-4-(morpholin-4-ium-4-ylmethyl)-5-oxidanyl-1-benzofuran-3-carboxamide

Systemtic Name: N-(2,6-diethylphenyl)-2-methyl-4-(morpholin-4-ium-4-ylmethyl)-5-oxidanyl-1-benzofuran-3-carboxamide Openeye Name: N-(2,6-diethylphenyl)-5-hydroxy-2-methyl-4-(morpholin-4-ium-4-ylmethyl)benzofuran-3-carboxamide CAS Name: N-(2,6-diethylphenyl)-5-hydroxy-2-methyl-4-(4-morpholin-4-iumylmethyl)-3-benzofurancarboxamide IUPAC Name: N-(2,6-diethylphenyl)-5-hydroxy-2-methyl-4-(morpholin-4-ium-4-ylmethyl)-1-benzofuran-3-carboxamide Traditional Name: N-(2,6-diethylphenyl)-5-hydroxy-2-methyl-4-(morpholin-4-ium-4-ylmethyl)benzofuran-3-carboxamide Formula: C25H31N2O4+ MolecularWeight: 423.52464

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C(OC3=C2C(=C(C=C3)O)C[NH+]4CCOCC4)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2=C(OC3=C2C(=C(C=C3)O)C[NH+]4CCOCC4)C

InChI

InChI=1S/C25H30N2O4/c1-4-17-7-6-8-18(5-2)24(17)26-25(29)22-16(3)31-21-10-9-20(28)19(23(21)22)15-27-11-13-30-14-12-27/h6-10,28H,4-5,11-15H2,1-3H3,(H,26,29)/p+1