1-[2-methyl-4-(morpholin-4-ium-4-ylmethyl)-5-oxidanyl-1-benzofuran-3-yl]ethanone

Systemtic Name: 1-[2-methyl-4-(morpholin-4-ium-4-ylmethyl)-5-oxidanyl-1-benzofuran-3-yl]ethanone Openeye Name: 1-[5-hydroxy-2-methyl-4-(morpholin-4-ium-4-ylmethyl)benzofuran-3-yl]ethanone CAS Name: 1-[5-hydroxy-2-methyl-4-(4-morpholin-4-iumylmethyl)-3-benzofuranyl]ethanone IUPAC Name: 1-[5-hydroxy-2-methyl-4-(morpholin-4-ium-4-ylmethyl)-1-benzofuran-3-yl]ethanone Traditional Name: 1-[5-hydroxy-2-methyl-4-(morpholin-4-ium-4-ylmethyl)benzofuran-3-yl]ethanone Formula: C16H20NO4+ MolecularWeight: 290.3343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO4/c1-10(18)15-11(2)21-14-4-3-13(19)12(16(14)15)9-17-5-7-20-8-6-17/h3-4,19H,5-9H2,1-2H3/p+1