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

Systemtic Name: 2-methyl-4-(morpholin-4-ium-4-ylmethyl)-5-oxidanyl-N-phenyl-1-benzofuran-3-carboxamide Openeye Name: 5-hydroxy-2-methyl-4-(morpholin-4-ium-4-ylmethyl)-N-phenyl-benzofuran-3-carboxamide CAS Name: 5-hydroxy-2-methyl-4-(4-morpholin-4-iumylmethyl)-N-phenyl-3-benzofurancarboxamide IUPAC Name: 5-hydroxy-2-methyl-4-(morpholin-4-ium-4-ylmethyl)-N-phenyl-1-benzofuran-3-carboxamide Traditional Name: 5-hydroxy-2-methyl-4-(morpholin-4-ium-4-ylmethyl)-N-phenyl-benzofuran-3-carboxamide Formula: C21H23N2O4+ MolecularWeight: 367.41832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2C[NH+]3CCOCC3)O)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2C[NH+]3CCOCC3)O)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C21H22N2O4/c1-14-19(21(25)22-15-5-3-2-4-6-15)20-16(13-23-9-11-26-12-10-23)17(24)7-8-18(20)27-14/h2-8,24H,9-13H2,1H3,(H,22,25)/p+1