[4-[(2S)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]methylazanium

Systemtic Name: [4-[(2S)-1-(3-methylbutylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]methylazanium Openeye Name: [4-[(1S)-2-(isopentylamino)-1-methyl-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [4-[(2S)-1-(3-methylbutylamino)-1-oxopropan-2-yl]oxyphenyl]methylammonium IUPAC Name: [4-[(2S)-1-(3-methylbutylamino)-1-oxopropan-2-yl]oxyphenyl]methylazanium Traditional Name: [4-[(1S)-2-(isoamylamino)-2-keto-1-methyl-ethoxy]benzyl]ammonium Formula: C15H25N2O2+ MolecularWeight: 265.3712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(C)OC1=CC=C(C=C1)C[NH3+]

Isomeric SMILES

C[C@@H](C(=O)NCCC(C)C)OC1=CC=C(C=C1)C[NH3+]

InChI

InChI=1S/C15H24N2O2/c1-11(2)8-9-17-15(18)12(3)19-14-6-4-13(10-16)5-7-14/h4-7,11-12H,8-10,16H2,1-3H3,(H,17,18)/p+1/t12-/m0/s1