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

Systemtic Name: 1-[(E)-1-(3,4-dimethoxyphenyl)-3-(4-ethylpiperazin-4-ium-1-yl)-3-oxidanylidene-prop-1-en-2-yl]pyridin-2-one Openeye Name: 1-[(E)-2-(3,4-dimethoxyphenyl)-1-(4-ethylpiperazin-4-ium-1-carbonyl)vinyl]pyridin-2-one CAS Name: 1-[(E)-1-(3,4-dimethoxyphenyl)-3-(4-ethyl-1-piperazin-4-iumyl)-3-oxoprop-1-en-2-yl]-2-pyridinone IUPAC Name: 1-[(E)-1-(3,4-dimethoxyphenyl)-3-(4-ethylpiperazin-4-ium-1-yl)-3-oxoprop-1-en-2-yl]pyridin-2-one Traditional Name: 1-[(E)-2-(3,4-dimethoxyphenyl)-1-(4-ethylpiperazin-4-ium-1-carbonyl)vinyl]-2-pyridone Formula: C22H28N3O4+ MolecularWeight: 398.47542

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C(=CC2=CC(=C(C=C2)OC)OC)N3C=CC=CC3=O

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)/C(=C\C2=CC(=C(C=C2)OC)OC)/N3C=CC=CC3=O

InChI

InChI=1S/C22H27N3O4/c1-4-23-11-13-24(14-12-23)22(27)18(25-10-6-5-7-21(25)26)15-17-8-9-19(28-2)20(16-17)29-3/h5-10,15-16H,4,11-14H2,1-3H3/p+1/b18-15+