1-[[4-ethoxy-2-(4-fluorophenyl)-2H-chromen-3-yl]methyl]piperidin-1-ium

Systemtic Name: 1-[[4-ethoxy-2-(4-fluorophenyl)-2H-chromen-3-yl]methyl]piperidin-1-ium Openeye Name: 1-[[4-ethoxy-2-(4-fluorophenyl)-2H-chromen-3-yl]methyl]piperidin-1-ium CAS Name: 1-[[4-ethoxy-2-(4-fluorophenyl)-2H-1-benzopyran-3-yl]methyl]piperidin-1-ium IUPAC Name: 1-[[4-ethoxy-2-(4-fluorophenyl)-2H-chromen-3-yl]methyl]piperidin-1-ium Traditional Name: 1-[[4-ethoxy-2-(4-fluorophenyl)-2H-chromen-3-yl]methyl]piperidin-1-ium Formula: C23H27FNO2+ MolecularWeight: 368.464383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(OC2=CC=CC=C21)C3=CC=C(C=C3)F)C[NH+]4CCCCC4

Isomeric SMILES

CCOC1=C(C(OC2=CC=CC=C21)C3=CC=C(C=C3)F)C[NH+]4CCCCC4

InChI

InChI=1S/C23H26FNO2/c1-2-26-23-19-8-4-5-9-21(19)27-22(17-10-12-18(24)13-11-17)20(23)16-25-14-6-3-7-15-25/h4-5,8-13,22H,2-3,6-7,14-16H2,1H3/p+1