[2-[(2S)-1-oxidanylidene-1-(pentan-3-ylamino)propan-2-yl]oxyphenyl]methylazanium

Systemtic Name: [2-[(2S)-1-oxidanylidene-1-(pentan-3-ylamino)propan-2-yl]oxyphenyl]methylazanium Openeye Name: [2-[(1S)-2-(1-ethylpropylamino)-1-methyl-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [2-[(2S)-1-oxo-1-(pentan-3-ylamino)propan-2-yl]oxyphenyl]methylammonium IUPAC Name: [2-[(2S)-1-oxo-1-(pentan-3-ylamino)propan-2-yl]oxyphenyl]methylazanium Traditional Name: [2-[(1S)-2-(1-ethylpropylamino)-2-keto-1-methyl-ethoxy]benzyl]ammonium Formula: C15H25N2O2+ MolecularWeight: 265.3712

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C(C)OC1=CC=CC=C1C[NH3+]

Isomeric SMILES

CCC(CC)NC(=O)[C@H](C)OC1=CC=CC=C1C[NH3+]

InChI

InChI=1S/C15H24N2O2/c1-4-13(5-2)17-15(18)11(3)19-14-9-7-6-8-12(14)10-16/h6-9,11,13H,4-5,10,16H2,1-3H3,(H,17,18)/p+1/t11-/m0/s1