(5-fluoranyl-2-methoxy-phenyl)-[(3S)-1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-3-yl]methanone

Systemtic Name: (5-fluoranyl-2-methoxy-phenyl)-[(3S)-1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-3-yl]methanone Openeye Name: (5-fluoro-2-methoxy-phenyl)-[(3S)-1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-3-yl]methanone CAS Name: (5-fluoro-2-methoxyphenyl)-[(3S)-1-[(1-methyl-3-indolyl)methyl]-3-piperidin-1-iumyl]methanone IUPAC Name: (5-fluoro-2-methoxyphenyl)-[(3S)-1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-3-yl]methanone Traditional Name: (5-fluoro-2-methoxy-phenyl)-[(3S)-1-[(1-methylindol-3-yl)methyl]piperidin-1-ium-3-yl]methanone Formula: C23H26FN2O2+ MolecularWeight: 381.463143

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C[NH+]3CCCC(C3)C(=O)C4=C(C=CC(=C4)F)OC

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C[NH+]3CCC[C@@H](C3)C(=O)C4=C(C=CC(=C4)F)OC

InChI

InChI=1S/C23H25FN2O2/c1-25-13-17(19-7-3-4-8-21(19)25)15-26-11-5-6-16(14-26)23(27)20-12-18(24)9-10-22(20)28-2/h3-4,7-10,12-13,16H,5-6,11,14-15H2,1-2H3/p+1/t16-/m0/s1