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4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-nitro-benzaldehyde

4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-nitro-benzaldehyde

Systemtic Name:4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-nitro-benzaldehyde
Openeye Name:4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-nitro-benzaldehyde
CAS Name:4-[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazin-4-iumyl]-3-nitrobenzaldehyde
IUPAC Name:4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-nitrobenzaldehyde
Traditional Name:4-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-3-nitro-benzaldehyde
Formula: C20H24N3O5+
MolecularWeight: 386.42166
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C20H23N3O5/c1-27-17-3-5-18(6-4-17)28-13-12-21-8-10-22(11-9-21)19-7-2-16(15-24)14-20(19)23(25)26/h2-7,14-15H,8-13H2,1H3/p+1


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