(E)-3-(3,4-dimethoxyphenyl)-1-(4-ethylpiperazin-4-ium-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-1-(4-ethylpiperazin-4-ium-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-1-(4-ethylpiperazin-4-ium-1-yl)prop-2-en-1-one CAS Name: (E)-3-(3,4-dimethoxyphenyl)-1-(4-ethyl-1-piperazin-4-iumyl)-2-propen-1-one IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-1-(4-ethylpiperazin-4-ium-1-yl)prop-2-en-1-one Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-1-(4-ethylpiperazin-4-ium-1-yl)prop-2-en-1-one Formula: C17H25N2O3+ MolecularWeight: 305.392

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C=CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O3/c1-4-18-9-11-19(12-10-18)17(20)8-6-14-5-7-15(21-2)16(13-14)22-3/h5-8,13H,4,9-12H2,1-3H3/p+1/b8-6+