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

Systemtic Name: cyclohexyl-methyl-[[2-[[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl]amino]phenyl]methyl]azanium Openeye Name: cyclohexyl-[[2-[[2-(isobutylcarbamoylamino)-2-oxo-ethyl]amino]phenyl]methyl]-methyl-ammonium CAS Name: cyclohexyl-methyl-[[2-[[2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl]amino]phenyl]methyl]ammonium IUPAC Name: cyclohexyl-methyl-[[2-[[2-(2-methylpropylcarbamoylamino)-2-oxoethyl]amino]phenyl]methyl]azanium Traditional Name: cyclohexyl-[2-[[2-(isobutylcarbamoylamino)-2-keto-ethyl]amino]benzyl]-methyl-ammonium Formula: C21H35N4O2+ MolecularWeight: 375.5282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H34N4O2/c1-16(2)13-23-21(27)24-20(26)14-22-19-12-8-7-9-17(19)15-25(3)18-10-5-4-6-11-18/h7-9,12,16,18,22H,4-6,10-11,13-15H2,1-3H3,(H2,23,24,26,27)/p+1