tert-butyl-[(2S)-3-(2-cyclopentylphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: tert-butyl-[(2S)-3-(2-cyclopentylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: tert-butyl-[(2S)-3-(2-cyclopentylphenoxy)-2-hydroxy-propyl]ammonium CAS Name: tert-butyl-[(2S)-3-(2-cyclopentylphenoxy)-2-hydroxypropyl]ammonium IUPAC Name: tert-butyl-[(2S)-3-(2-cyclopentylphenoxy)-2-hydroxypropyl]azanium Traditional Name: tert-butyl-[(2S)-3-(2-cyclopentylphenoxy)-2-hydroxy-propyl]ammonium Formula: C18H30NO2+ MolecularWeight: 292.4363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(COC1=CC=CC=C1C2CCCC2)O

Isomeric SMILES

CC(C)(C)[NH2+]C[C@@H](COC1=CC=CC=C1C2CCCC2)O

InChI

InChI=1S/C18H29NO2/c1-18(2,3)19-12-15(20)13-21-17-11-7-6-10-16(17)14-8-4-5-9-14/h6-7,10-11,14-15,19-20H,4-5,8-9,12-13H2,1-3H3/p+1/t15-/m0/s1