[(2R)-1-(cyclohexylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: [(2R)-1-(cyclohexylcarbamoylamino)-1-oxidanylidene-propan-2-yl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (4-allyloxyphenyl)methyl-[(1R)-2-(cyclohexylcarbamoylamino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: [(2R)-1-[[(cyclohexylamino)-oxomethyl]amino]-1-oxopropan-2-yl]-methyl-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: [(2R)-1-(cyclohexylcarbamoylamino)-1-oxopropan-2-yl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxybenzyl)-[(1R)-2-(cyclohexylcarbamoylamino)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C21H32N3O3+ MolecularWeight: 374.49708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCCC1)[NH+](C)CC2=CC=C(C=C2)OCC=C

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC1CCCCC1)[NH+](C)CC2=CC=C(C=C2)OCC=C

InChI

InChI=1S/C21H31N3O3/c1-4-14-27-19-12-10-17(11-13-19)15-24(3)16(2)20(25)23-21(26)22-18-8-6-5-7-9-18/h4,10-13,16,18H,1,5-9,14-15H2,2-3H3,(H2,22,23,25,26)/p+1/t16-/m1/s1