[4-methoxy-3-[(2S)-1-(2-methylbutan-2-ylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]methylazanium

Systemtic Name: [4-methoxy-3-[(2S)-1-(2-methylbutan-2-ylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]methylazanium Openeye Name: [3-[(1S)-2-(1,1-dimethylpropylamino)-1-methyl-2-oxo-ethoxy]-4-methoxy-phenyl]methylammonium CAS Name: [4-methoxy-3-[(2S)-1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]oxyphenyl]methylammonium IUPAC Name: [4-methoxy-3-[(2S)-1-(2-methylbutan-2-ylamino)-1-oxopropan-2-yl]oxyphenyl]methylazanium Traditional Name: [3-[(1S)-2-(tert-amylamino)-2-keto-1-methyl-ethoxy]-4-methoxy-benzyl]ammonium Formula: C16H27N2O3+ MolecularWeight: 295.39718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C(C)OC1=C(C=CC(=C1)C[NH3+])OC

Isomeric SMILES

CCC(C)(C)NC(=O)[C@H](C)OC1=C(C=CC(=C1)C[NH3+])OC

InChI

InChI=1S/C16H26N2O3/c1-6-16(3,4)18-15(19)11(2)21-14-9-12(10-17)7-8-13(14)20-5/h7-9,11H,6,10,17H2,1-5H3,(H,18,19)/p+1/t11-/m0/s1