[(2S)-1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]-2-methyl-propyl]ammonium CAS Name: [(2S)-1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-(homoveratrylcarbamoyl)-2-methyl-propyl]ammonium Formula: C15H25N2O3+ MolecularWeight: 281.3706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCC1=CC(=C(C=C1)OC)OC)[NH3+]

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCC1=CC(=C(C=C1)OC)OC)[NH3+]

InChI

InChI=1S/C15H24N2O3/c1-10(2)14(16)15(18)17-8-7-11-5-6-12(19-3)13(9-11)20-4/h5-6,9-10,14H,7-8,16H2,1-4H3,(H,17,18)/p+1/t14-/m0/s1