[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-methyl-[2-(3-methylphenoxy)ethyl]azanium

Systemtic Name: [(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-methyl-[2-(3-methylphenoxy)ethyl]azanium Openeye Name: [(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]-methyl-[2-(3-methylphenoxy)ethyl]ammonium CAS Name: [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]-methyl-[2-(3-methylphenoxy)ethyl]ammonium IUPAC Name: [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]-methyl-[2-(3-methylphenoxy)ethyl]azanium Traditional Name: [(1S)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl]-methyl-[2-(3-methylphenoxy)ethyl]ammonium Formula: C19H31N2O2+ MolecularWeight: 319.46164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC[NH+](C)C(C)C(=O)NC2CCCCC2

Isomeric SMILES

CC1=CC(=CC=C1)OCC[NH+](C)[C@@H](C)C(=O)NC2CCCCC2

InChI

InChI=1S/C19H30N2O2/c1-15-8-7-11-18(14-15)23-13-12-21(3)16(2)19(22)20-17-9-5-4-6-10-17/h7-8,11,14,16-17H,4-6,9-10,12-13H2,1-3H3,(H,20,22)/p+1/t16-/m0/s1