[(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [(2S)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]-methyl-(2-phenoxyethyl)azanium Openeye Name: [(1S)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]-methyl-(2-phenoxyethyl)ammonium CAS Name: [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]-methyl-(2-phenoxyethyl)azanium Traditional Name: [(1S)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C18H29N2O2+ MolecularWeight: 305.43506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)[NH+](C)CCOC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)NC1CCCCC1)[NH+](C)CCOC2=CC=CC=C2

InChI

InChI=1S/C18H28N2O2/c1-15(18(21)19-16-9-5-3-6-10-16)20(2)13-14-22-17-11-7-4-8-12-17/h4,7-8,11-12,15-16H,3,5-6,9-10,13-14H2,1-2H3,(H,19,21)/p+1/t15-/m0/s1