2-fluoranyl-6-methoxy-2-[1-methyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-5-propoxy-3H-inden-1-one

Systemtic Name: 2-fluoranyl-6-methoxy-2-[1-methyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-5-propoxy-3H-inden-1-one Openeye Name: 2-(1-benzyl-1-methyl-piperidin-1-ium-4-yl)-2-fluoro-6-methoxy-5-propoxy-indan-1-one CAS Name: 2-fluoro-6-methoxy-2-[1-methyl-1-(phenylmethyl)-4-piperidin-1-iumyl]-5-propoxy-3H-inden-1-one IUPAC Name: 2-(1-benzyl-1-methylpiperidin-1-ium-4-yl)-2-fluoro-6-methoxy-5-propoxy-3H-inden-1-one Traditional Name: 2-(1-benzyl-1-methyl-piperidin-1-ium-4-yl)-2-fluoro-6-methoxy-5-propoxy-indan-1-one Formula: C26H33FNO3+ MolecularWeight: 426.543523

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C2C(=C1)CC(C2=O)(C3CC[N+](CC3)(C)CC4=CC=CC=C4)F)OC

Isomeric SMILES

CCCOC1=C(C=C2C(=C1)CC(C2=O)(C3CC[N+](CC3)(C)CC4=CC=CC=C4)F)OC

InChI

InChI=1S/C26H33FNO3/c1-4-14-31-24-15-20-17-26(27,25(29)22(20)16-23(24)30-3)21-10-12-28(2,13-11-21)18-19-8-6-5-7-9-19/h5-9,15-16,21H,4,10-14,17-18H2,1-3H3/q+1