[3-[(2S)-butan-2-yl]oxy-4-methoxy-phenyl]methylazanium

Systemtic Name: [3-[(2S)-butan-2-yl]oxy-4-methoxy-phenyl]methylazanium Openeye Name: [4-methoxy-3-[(1S)-1-methylpropoxy]phenyl]methylammonium CAS Name: [3-[(2S)-butan-2-yl]oxy-4-methoxyphenyl]methylammonium IUPAC Name: [3-[(2S)-butan-2-yl]oxy-4-methoxyphenyl]methylazanium Traditional Name: [4-methoxy-3-[(1S)-1-methylpropoxy]benzyl]ammonium Formula: C12H20NO2+ MolecularWeight: 210.2927

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO2/c1-4-9(2)15-12-7-10(8-13)5-6-11(12)14-3/h5-7,9H,4,8,13H2,1-3H3/p+1/t9-/m0/s1