[2-[[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl]amino]phenyl]methyl-cyclohexyl-methyl-azanium

Systemtic Name: [2-[[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl]amino]phenyl]methyl-cyclohexyl-methyl-azanium Openeye Name: [2-[[2-(tert-butylcarbamoylamino)-2-oxo-ethyl]amino]phenyl]methyl-cyclohexyl-methyl-ammonium CAS Name: [2-[[2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl]amino]phenyl]methyl-cyclohexyl-methylammonium IUPAC Name: [2-[[2-(tert-butylcarbamoylamino)-2-oxoethyl]amino]phenyl]methyl-cyclohexyl-methylazanium Traditional Name: [2-[[2-(tert-butylcarbamoylamino)-2-keto-ethyl]amino]benzyl]-cyclohexyl-methyl-ammonium Formula: C21H35N4O2+ MolecularWeight: 375.5282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)CNC1=CC=CC=C1C[NH+](C)C2CCCCC2

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)CNC1=CC=CC=C1C[NH+](C)C2CCCCC2

InChI

InChI=1S/C21H34N4O2/c1-21(2,3)24-20(27)23-19(26)14-22-18-13-9-8-10-16(18)15-25(4)17-11-6-5-7-12-17/h8-10,13,17,22H,5-7,11-12,14-15H2,1-4H3,(H2,23,24,26,27)/p+1