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

Systemtic Name: 1-[(E)-1-(3,4-dimethoxyphenyl)-3-(4-methylpiperazin-4-ium-1-yl)-3-oxidanylidene-prop-1-en-2-yl]pyridin-2-one Openeye Name: 1-[(E)-2-(3,4-dimethoxyphenyl)-1-(4-methylpiperazin-4-ium-1-carbonyl)vinyl]pyridin-2-one CAS Name: 1-[(E)-1-(3,4-dimethoxyphenyl)-3-(4-methyl-1-piperazin-4-iumyl)-3-oxoprop-1-en-2-yl]-2-pyridinone IUPAC Name: 1-[(E)-1-(3,4-dimethoxyphenyl)-3-(4-methylpiperazin-4-ium-1-yl)-3-oxoprop-1-en-2-yl]pyridin-2-one Traditional Name: 1-[(E)-2-(3,4-dimethoxyphenyl)-1-(4-methylpiperazin-4-ium-1-carbonyl)vinyl]-2-pyridone Formula: C21H26N3O4+ MolecularWeight: 384.44884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4/c1-22-10-12-23(13-11-22)21(26)17(24-9-5-4-6-20(24)25)14-16-7-8-18(27-2)19(15-16)28-3/h4-9,14-15H,10-13H2,1-3H3/p+1/b17-14+