4-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-benzaldehyde

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-benzaldehyde Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-benzaldehyde CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)-3-phenylbenzaldehyde IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-phenylbenzaldehyde Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-benzaldehyde Formula: C18H21N2O+ MolecularWeight: 281.37214

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C=O)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)C=O)C3=CC=CC=C3

InChI

InChI=1S/C18H20N2O/c1-19-9-11-20(12-10-19)18-8-7-15(14-21)13-17(18)16-5-3-2-4-6-16/h2-8,13-14H,9-12H2,1H3/p+1