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

Systemtic Name: 4-[[1-(2-azanyl-2-oxidanylidene-ethyl)-4-methyl-piperazin-1-ium-1-yl]methyl]-N-[(2-methylpropan-2-yl)oxy]benzamide Openeye Name: 4-[[1-(2-amino-2-oxo-ethyl)-4-methyl-piperazin-1-ium-1-yl]methyl]-N-tert-butoxy-benzamide CAS Name: 4-[[1-(2-amino-2-oxoethyl)-4-methyl-1-piperazin-1-iumyl]methyl]-N-[(2-methylpropan-2-yl)oxy]benzamide IUPAC Name: 4-[[1-(2-amino-2-oxoethyl)-4-methylpiperazin-1-ium-1-yl]methyl]-N-[(2-methylpropan-2-yl)oxy]benzamide Traditional Name: 4-[[1-(2-amino-2-keto-ethyl)-4-methyl-piperazin-1-ium-1-yl]methyl]-N-tert-butoxy-benzamide Formula: C19H31N4O3+ MolecularWeight: 363.47444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)ONC(=O)C1=CC=C(C=C1)C[N+]2(CCN(CC2)C)CC(=O)N

Isomeric SMILES

CC(C)(C)ONC(=O)C1=CC=C(C=C1)C[N+]2(CCN(CC2)C)CC(=O)N

InChI

InChI=1S/C19H30N4O3/c1-19(2,3)26-21-18(25)16-7-5-15(6-8-16)13-23(14-17(20)24)11-9-22(4)10-12-23/h5-8H,9-14H2,1-4H3,(H2-,20,21,24,25)/p+1