1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-(4-fluorophenyl)-1,2,3,6-tetrahydropyridin-1-ium

Systemtic Name: 1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-(4-fluorophenyl)-1,2,3,6-tetrahydropyridin-1-ium Openeye Name: 1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-(4-fluorophenyl)-1,2,3,6-tetrahydropyridin-1-ium CAS Name: 1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-(4-fluorophenyl)-1,2,3,6-tetrahydropyridin-1-ium IUPAC Name: 1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-(4-fluorophenyl)-1,2,3,6-tetrahydropyridin-1-ium Traditional Name: 1-(3-ethoxy-4-methoxy-benzyl)-4-(4-fluorophenyl)-1,2,3,6-tetrahydropyridin-1-ium Formula: C21H25FNO2+ MolecularWeight: 342.427103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH+]2CCC(=CC2)C3=CC=C(C=C3)F)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH+]2CCC(=CC2)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H24FNO2/c1-3-25-21-14-16(4-9-20(21)24-2)15-23-12-10-18(11-13-23)17-5-7-19(22)8-6-17/h4-10,14H,3,11-13,15H2,1-2H3/p+1