1-[4-[4-[(E)-3-(2-methoxyphenyl)prop-2-enyl]piperazin-4-ium-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[(E)-3-(2-methoxyphenyl)prop-2-enyl]piperazin-4-ium-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[(E)-3-(2-methoxyphenyl)allyl]piperazin-4-ium-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[(E)-3-(2-methoxyphenyl)prop-2-enyl]-1-piperazin-4-iumyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[(E)-3-(2-methoxyphenyl)prop-2-enyl]piperazin-4-ium-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[(E)-3-(2-methoxyphenyl)allyl]piperazin-4-ium-1-yl]phenyl]ethanone Formula: C22H27N2O2+ MolecularWeight: 351.46198

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC=CC3=CC=CC=C3OC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)C/C=C/C3=CC=CC=C3OC

InChI

InChI=1S/C22H26N2O2/c1-18(25)19-9-11-21(12-10-19)24-16-14-23(15-17-24)13-5-7-20-6-3-4-8-22(20)26-2/h3-12H,13-17H2,1-2H3/p+1/b7-5+