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

Systemtic Name: tert-butyl-[(2S)-2-(3-methoxy-4-propan-2-yloxy-phenyl)-2-oxidanyl-propyl]azanium Openeye Name: tert-butyl-[(2S)-2-hydroxy-2-(4-isopropoxy-3-methoxy-phenyl)propyl]ammonium CAS Name: tert-butyl-[(2S)-2-hydroxy-2-(3-methoxy-4-propan-2-yloxyphenyl)propyl]ammonium IUPAC Name: tert-butyl-[(2S)-2-hydroxy-2-(3-methoxy-4-propan-2-yloxyphenyl)propyl]azanium Traditional Name: tert-butyl-[(2S)-2-hydroxy-2-(4-isopropoxy-3-methoxy-phenyl)propyl]ammonium Formula: C17H30NO3+ MolecularWeight: 296.425

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(C)(C[NH2+]C(C)(C)C)O)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)[C@@](C)(C[NH2+]C(C)(C)C)O)OC

InChI

InChI=1S/C17H29NO3/c1-12(2)21-14-9-8-13(10-15(14)20-7)17(6,19)11-18-16(3,4)5/h8-10,12,18-19H,11H2,1-7H3/p+1/t17-/m1/s1