[3-[2-[(1S,3S)-3-methylcyclohexyl]oxyethanoylamino]phenyl]methylazanium

Systemtic Name: [3-[2-[(1S,3S)-3-methylcyclohexyl]oxyethanoylamino]phenyl]methylazanium Openeye Name: [3-[[2-[(1S,3S)-3-methylcyclohexoxy]acetyl]amino]phenyl]methylammonium CAS Name: [3-[[2-[(1S,3S)-3-methylcyclohexyl]oxy-1-oxoethyl]amino]phenyl]methylammonium IUPAC Name: [3-[[2-[(1S,3S)-3-methylcyclohexyl]oxyacetyl]amino]phenyl]methylazanium Traditional Name: [3-[[2-[(1S,3S)-3-methylcyclohexoxy]acetyl]amino]benzyl]ammonium Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)OCC(=O)NC2=CC=CC(=C2)C[NH3+]

Isomeric SMILES

C[C@H]1CCC[C@@H](C1)OCC(=O)NC2=CC=CC(=C2)C[NH3+]

InChI

InChI=1S/C16H24N2O2/c1-12-4-2-7-15(8-12)20-11-16(19)18-14-6-3-5-13(9-14)10-17/h3,5-6,9,12,15H,2,4,7-8,10-11,17H2,1H3,(H,18,19)/p+1/t12-,15-/m0/s1