[4-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-oxidanyl-1-benzofuran-3-yl]-phenyl-methanone

Systemtic Name: [4-[(4-methylpiperidin-1-ium-1-yl)methyl]-5-oxidanyl-1-benzofuran-3-yl]-phenyl-methanone Openeye Name: [5-hydroxy-4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzofuran-3-yl]-phenyl-methanone CAS Name: [5-hydroxy-4-[(4-methyl-1-piperidin-1-iumyl)methyl]-3-benzofuranyl]-phenylmethanone IUPAC Name: [5-hydroxy-4-[(4-methylpiperidin-1-ium-1-yl)methyl]-1-benzofuran-3-yl]-phenylmethanone Traditional Name: [5-hydroxy-4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzofuran-3-yl]-phenyl-methanone Formula: C22H24NO3+ MolecularWeight: 350.43086

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC2=C(C=CC3=C2C(=CO3)C(=O)C4=CC=CC=C4)O

Isomeric SMILES

CC1CC[NH+](CC1)CC2=C(C=CC3=C2C(=CO3)C(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C22H23NO3/c1-15-9-11-23(12-10-15)13-17-19(24)7-8-20-21(17)18(14-26-20)22(25)16-5-3-2-4-6-16/h2-8,14-15,24H,9-13H2,1H3/p+1