[(2S)-3-(2-tert-butyl-4-methyl-phenoxy)-2-oxidanyl-propyl]-cyclopentyl-azanium

Systemtic Name: [(2S)-3-(2-tert-butyl-4-methyl-phenoxy)-2-oxidanyl-propyl]-cyclopentyl-azanium Openeye Name: [(2S)-3-(2-tert-butyl-4-methyl-phenoxy)-2-hydroxy-propyl]-cyclopentyl-ammonium CAS Name: [(2S)-3-(2-tert-butyl-4-methylphenoxy)-2-hydroxypropyl]-cyclopentylammonium IUPAC Name: [(2S)-3-(2-tert-butyl-4-methylphenoxy)-2-hydroxypropyl]-cyclopentylazanium Traditional Name: [(2S)-3-(2-tert-butyl-4-methyl-phenoxy)-2-hydroxy-propyl]-cyclopentyl-ammonium Formula: C19H32NO2+ MolecularWeight: 306.46288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(C[NH2+]C2CCCC2)O)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC[C@H](C[NH2+]C2CCCC2)O)C(C)(C)C

InChI

InChI=1S/C19H31NO2/c1-14-9-10-18(17(11-14)19(2,3)4)22-13-16(21)12-20-15-7-5-6-8-15/h9-11,15-16,20-21H,5-8,12-13H2,1-4H3/p+1/t16-/m0/s1