3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4-methoxy-benzaldehyde

Systemtic Name: 3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4-methoxy-benzaldehyde Openeye Name: 3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4-methoxy-benzaldehyde CAS Name: 3-[[4-(2-fluorophenyl)-1-piperazin-1-iumyl]methyl]-4-methoxybenzaldehyde IUPAC Name: 3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4-methoxybenzaldehyde Traditional Name: 3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4-methoxy-benzaldehyde Formula: C19H22FN2O2+ MolecularWeight: 329.388583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=O)C[NH+]2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

COC1=C(C=C(C=C1)C=O)C[NH+]2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C19H21FN2O2/c1-24-19-7-6-15(14-23)12-16(19)13-21-8-10-22(11-9-21)18-5-3-2-4-17(18)20/h2-7,12,14H,8-11,13H2,1H3/p+1