cyclopentyl-[(2S)-3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: cyclopentyl-[(2S)-3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: cyclopentyl-[(2S)-3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]ammonium CAS Name: cyclopentyl-[(2S)-3-(2,5-dimethylphenoxy)-2-hydroxypropyl]ammonium IUPAC Name: cyclopentyl-[(2S)-3-(2,5-dimethylphenoxy)-2-hydroxypropyl]azanium Traditional Name: cyclopentyl-[(2S)-3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]ammonium Formula: C16H26NO2+ MolecularWeight: 264.38314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO2/c1-12-7-8-13(2)16(9-12)19-11-15(18)10-17-14-5-3-4-6-14/h7-9,14-15,17-18H,3-6,10-11H2,1-2H3/p+1/t15-/m0/s1