N-butyl-2-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethoxy]ethanamide

Systemtic Name: N-butyl-2-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethoxy]ethanamide Openeye Name: 2-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxo-ethoxy]-N-butyl-acetamide CAS Name: N-butyl-2-[2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-oxoethoxy]acetamide IUPAC Name: 2-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxoethoxy]-N-butylacetamide Traditional Name: 2-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-keto-ethoxy]-N-butyl-acetamide Formula: C25H34N3O3+ MolecularWeight: 424.55576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COCC(=O)N1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)COCC(=O)N1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O3/c1-2-3-14-26-23(29)19-31-20-24(30)27-15-17-28(18-16-27)25(21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-13,25H,2-3,14-20H2,1H3,(H,26,29)/p+1