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

Systemtic Name: tert-butyl-[(2S)-2-[3-methoxy-4-(2-methylpropoxy)phenyl]-2-oxidanyl-ethyl]azanium Openeye Name: tert-butyl-[(2S)-2-hydroxy-2-(4-isobutoxy-3-methoxy-phenyl)ethyl]ammonium CAS Name: tert-butyl-[(2S)-2-hydroxy-2-[3-methoxy-4-(2-methylpropoxy)phenyl]ethyl]ammonium IUPAC Name: tert-butyl-[(2S)-2-hydroxy-2-[3-methoxy-4-(2-methylpropoxy)phenyl]ethyl]azanium Traditional Name: tert-butyl-[(2S)-2-hydroxy-2-(4-isobutoxy-3-methoxy-phenyl)ethyl]ammonium Formula: C17H30NO3+ MolecularWeight: 296.425

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29NO3/c1-12(2)11-21-15-8-7-13(9-16(15)20-6)14(19)10-18-17(3,4)5/h7-9,12,14,18-19H,10-11H2,1-6H3/p+1/t14-/m1/s1