2-[1-[4-[(E)-2-(4-nitrophenyl)ethenyl]phenyl]piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[1-[4-[(E)-2-(4-nitrophenyl)ethenyl]phenyl]piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[1-[4-[(E)-2-(4-nitrophenyl)vinyl]phenyl]piperazin-1-ium-1-yl]ethanol CAS Name: 2-[1-[4-[(E)-2-(4-nitrophenyl)ethenyl]phenyl]-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[1-[4-[(E)-2-(4-nitrophenyl)ethenyl]phenyl]piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[1-[4-[(E)-2-(4-nitrophenyl)vinyl]phenyl]piperazin-1-ium-1-yl]ethanol Formula: C20H24N3O3+ MolecularWeight: 354.42286

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(CCO)C2=CC=C(C=C2)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C[N+](CCN1)(CCO)C2=CC=C(C=C2)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N3O3/c24-16-15-23(13-11-21-12-14-23)20-9-5-18(6-10-20)2-1-17-3-7-19(8-4-17)22(25)26/h1-10,21,24H,11-16H2/q+1/b2-1+