(E)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)prop-2-enamide Openeye Name: (E)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)prop-2-enamide CAS Name: (E)-N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-(4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(4-methoxyphenyl)acrylamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C=CC3=CC=C(C=C3)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)/C=C/C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H27N3O2/c1-3-24-14-16-25(17-15-24)21-7-5-4-6-20(21)23-22(26)13-10-18-8-11-19(27-2)12-9-18/h4-13H,3,14-17H2,1-2H3,(H,23,26)/p+1/b13-10+