tert-butyl-[(2S)-2-[2-[(4-methylphenyl)methoxy]phenyl]-2-oxidanyl-ethyl]azanium

Systemtic Name: tert-butyl-[(2S)-2-[2-[(4-methylphenyl)methoxy]phenyl]-2-oxidanyl-ethyl]azanium Openeye Name: tert-butyl-[(2S)-2-hydroxy-2-[2-(p-tolylmethoxy)phenyl]ethyl]ammonium CAS Name: tert-butyl-[(2S)-2-hydroxy-2-[2-[(4-methylphenyl)methoxy]phenyl]ethyl]ammonium IUPAC Name: tert-butyl-[(2S)-2-hydroxy-2-[2-[(4-methylphenyl)methoxy]phenyl]ethyl]azanium Traditional Name: tert-butyl-[(2S)-2-hydroxy-2-[2-(4-methylbenzyl)oxyphenyl]ethyl]ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC=CC=C2C(C[NH2+]C(C)(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC=CC=C2[C@@H](C[NH2+]C(C)(C)C)O

InChI

InChI=1S/C20H27NO2/c1-15-9-11-16(12-10-15)14-23-19-8-6-5-7-17(19)18(22)13-21-20(2,3)4/h5-12,18,21-22H,13-14H2,1-4H3/p+1/t18-/m1/s1