N-tert-butyl-2-[4-[2-[(2-methoxyphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-[(2-methoxyphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-[(2-methoxyphenyl)methyl-methyl-amino]-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[2-[(2-methoxyphenyl)methyl-methylamino]-2-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-[(2-methoxyphenyl)methyl-methylamino]-2-oxoethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-keto-2-[methyl(o-anisyl)amino]ethyl]piperazin-1-ium-1-yl]acetamide Formula: C21H35N4O3+ MolecularWeight: 391.5276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)CC(=O)N(C)CC2=CC=CC=C2OC

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)CC(=O)N(C)CC2=CC=CC=C2OC

InChI

InChI=1S/C21H34N4O3/c1-21(2,3)22-19(26)15-24-10-12-25(13-11-24)16-20(27)23(4)14-17-8-6-7-9-18(17)28-5/h6-9H,10-16H2,1-5H3,(H,22,26)/p+1