1-[2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]pyridin-2-one

Systemtic Name: 1-[2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]pyridin-2-one Openeye Name: 1-[2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-2-oxo-ethyl]pyridin-2-one CAS Name: 1-[2-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazin-4-iumyl]-2-oxoethyl]-2-pyridinone IUPAC Name: 1-[2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-2-oxoethyl]pyridin-2-one Traditional Name: 1-[2-[4-(2,5-dimethoxybenzyl)piperazin-4-ium-1-yl]-2-keto-ethyl]-2-pyridone Formula: C20H26N3O4+ MolecularWeight: 372.43814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C[NH+]2CCN(CC2)C(=O)CN3C=CC=CC3=O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C[NH+]2CCN(CC2)C(=O)CN3C=CC=CC3=O

InChI

InChI=1S/C20H25N3O4/c1-26-17-6-7-18(27-2)16(13-17)14-21-9-11-22(12-10-21)20(25)15-23-8-4-3-5-19(23)24/h3-8,13H,9-12,14-15H2,1-2H3/p+1