[4-[2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethoxy]phenyl]methylazanium

Systemtic Name: [4-[2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethoxy]phenyl]methylazanium Openeye Name: [4-[2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [4-[2-oxo-2-[[(2S)-pentan-2-yl]amino]ethoxy]phenyl]methylammonium IUPAC Name: [4-[2-oxo-2-[[(2S)-pentan-2-yl]amino]ethoxy]phenyl]methylazanium Traditional Name: [4-[2-keto-2-[[(1S)-1-methylbutyl]amino]ethoxy]benzyl]ammonium Formula: C14H23N2O2+ MolecularWeight: 251.34462

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

CCC[C@H](C)NC(=O)COC1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C14H22N2O2/c1-3-4-11(2)16-14(17)10-18-13-7-5-12(9-15)6-8-13/h5-8,11H,3-4,9-10,15H2,1-2H3,(H,16,17)/p+1/t11-/m0/s1