3-[4-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-4-oxidanylidene-butyl]-1-methyl-imidazolidine-2,4-dione

Systemtic Name: 3-[4-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-4-oxidanylidene-butyl]-1-methyl-imidazolidine-2,4-dione Openeye Name: 3-[4-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-4-oxo-butyl]-1-methyl-imidazolidine-2,4-dione CAS Name: 3-[4-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazin-4-iumyl]-4-oxobutyl]-1-methylimidazolidine-2,4-dione IUPAC Name: 3-[4-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-4-oxobutyl]-1-methylimidazolidine-2,4-dione Traditional Name: 3-[4-keto-4-(4-veratrylpiperazin-4-ium-1-yl)butyl]-1-methyl-hydantoin Formula: C21H31N4O5+ MolecularWeight: 419.49464

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=O)N(C1=O)CCCC(=O)N2CC[NH+](CC2)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN1CC(=O)N(C1=O)CCCC(=O)N2CC[NH+](CC2)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H30N4O5/c1-22-15-20(27)25(21(22)28)8-4-5-19(26)24-11-9-23(10-12-24)14-16-6-7-17(29-2)18(13-16)30-3/h6-7,13H,4-5,8-12,14-15H2,1-3H3/p+1