4-[4-[(1R)-1-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]benzaldehyde

Systemtic Name: 4-[4-[(1R)-1-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]benzaldehyde Openeye Name: 4-[4-[(1R)-1-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]benzaldehyde CAS Name: 4-[4-[(1R)-1-(4-methoxyphenyl)ethyl]-1-piperazin-4-iumyl]benzaldehyde IUPAC Name: 4-[4-[(1R)-1-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]benzaldehyde Traditional Name: 4-[4-[(1R)-1-(4-methoxyphenyl)ethyl]piperazin-4-ium-1-yl]benzaldehyde Formula: C20H25N2O2+ MolecularWeight: 325.4247

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)OC)[NH+]2CCN(CC2)C3=CC=C(C=C3)C=O

InChI

InChI=1S/C20H24N2O2/c1-16(18-5-9-20(24-2)10-6-18)21-11-13-22(14-12-21)19-7-3-17(15-23)4-8-19/h3-10,15-16H,11-14H2,1-2H3/p+1/t16-/m1/s1