[4-methoxy-3-(2-methylpropoxy)phenyl]methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: [4-methoxy-3-(2-methylpropoxy)phenyl]methyl-[(1R)-1-phenylethyl]azanium Openeye Name: (3-isobutoxy-4-methoxy-phenyl)methyl-[(1R)-1-phenylethyl]ammonium CAS Name: [4-methoxy-3-(2-methylpropoxy)phenyl]methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: [4-methoxy-3-(2-methylpropoxy)phenyl]methyl-[(1R)-1-phenylethyl]azanium Traditional Name: (3-isobutoxy-4-methoxy-benzyl)-[(1R)-1-phenylethyl]ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=CC(=C1)C[NH2+]C(C)C2=CC=CC=C2)OC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+]CC2=CC(=C(C=C2)OC)OCC(C)C

InChI

InChI=1S/C20H27NO2/c1-15(2)14-23-20-12-17(10-11-19(20)22-4)13-21-16(3)18-8-6-5-7-9-18/h5-12,15-16,21H,13-14H2,1-4H3/p+1/t16-/m1/s1