4-[1-(2-azanyl-2-oxidanylidene-ethyl)-4-methyl-1-phenyl-piperazin-1-ium-2-yl]-N-[(2-methylpropan-2-yl)oxy]benzamide

Systemtic Name: 4-[1-(2-azanyl-2-oxidanylidene-ethyl)-4-methyl-1-phenyl-piperazin-1-ium-2-yl]-N-[(2-methylpropan-2-yl)oxy]benzamide Openeye Name: 4-[1-(2-amino-2-oxo-ethyl)-4-methyl-1-phenyl-piperazin-1-ium-2-yl]-N-tert-butoxy-benzamide CAS Name: 4-[1-(2-amino-2-oxoethyl)-4-methyl-1-phenyl-2-piperazin-1-iumyl]-N-[(2-methylpropan-2-yl)oxy]benzamide IUPAC Name: 4-[1-(2-amino-2-oxoethyl)-4-methyl-1-phenylpiperazin-1-ium-2-yl]-N-[(2-methylpropan-2-yl)oxy]benzamide Traditional Name: 4-[1-(2-amino-2-keto-ethyl)-4-methyl-1-phenyl-piperazin-1-ium-2-yl]-N-tert-butoxy-benzamide Formula: C24H33N4O3+ MolecularWeight: 425.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)ONC(=O)C1=CC=C(C=C1)C2CN(CC[N+]2(CC(=O)N)C3=CC=CC=C3)C

Isomeric SMILES

CC(C)(C)ONC(=O)C1=CC=C(C=C1)C2CN(CC[N+]2(CC(=O)N)C3=CC=CC=C3)C

InChI

InChI=1S/C24H32N4O3/c1-24(2,3)31-26-23(30)19-12-10-18(11-13-19)21-16-27(4)14-15-28(21,17-22(25)29)20-8-6-5-7-9-20/h5-13,21H,14-17H2,1-4H3,(H2-,25,26,29,30)/p+1