tert-butyl-[(2S)-2-[3-methoxy-4-(2-methylpropoxy)phenyl]-2-oxidanyl-propyl]azanium

Systemtic Name: tert-butyl-[(2S)-2-[3-methoxy-4-(2-methylpropoxy)phenyl]-2-oxidanyl-propyl]azanium Openeye Name: tert-butyl-[(2S)-2-hydroxy-2-(4-isobutoxy-3-methoxy-phenyl)propyl]ammonium CAS Name: tert-butyl-[(2S)-2-hydroxy-2-[3-methoxy-4-(2-methylpropoxy)phenyl]propyl]ammonium IUPAC Name: tert-butyl-[(2S)-2-hydroxy-2-[3-methoxy-4-(2-methylpropoxy)phenyl]propyl]azanium Traditional Name: tert-butyl-[(2S)-2-hydroxy-2-(4-isobutoxy-3-methoxy-phenyl)propyl]ammonium Formula: C18H32NO3+ MolecularWeight: 310.45158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H31NO3/c1-13(2)11-22-15-9-8-14(10-16(15)21-7)18(6,20)12-19-17(3,4)5/h8-10,13,19-20H,11-12H2,1-7H3/p+1/t18-/m1/s1