N-butyl-2-[4-[2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[2-(3,5-dimethoxyanilino)-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-butyl-2-[4-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-butyl-2-[4-[2-(3,5-dimethoxyanilino)-2-oxoethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-butyl-2-[4-[2-(3,5-dimethoxyanilino)-2-keto-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C20H33N4O4+ MolecularWeight: 393.50042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C[NH+]1CCN(CC1)CC(=O)NC2=CC(=CC(=C2)OC)OC

Isomeric SMILES

CCCCNC(=O)C[NH+]1CCN(CC1)CC(=O)NC2=CC(=CC(=C2)OC)OC

InChI

InChI=1S/C20H32N4O4/c1-4-5-6-21-19(25)14-23-7-9-24(10-8-23)15-20(26)22-16-11-17(27-2)13-18(12-16)28-3/h11-13H,4-10,14-15H2,1-3H3,(H,21,25)(H,22,26)/p+1