[(2S)-3-(3-ethylphenoxy)-2-oxidanyl-propyl]-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]azanium

Systemtic Name: [(2S)-3-(3-ethylphenoxy)-2-oxidanyl-propyl]-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]azanium Openeye Name: [(2S)-3-(3-ethylphenoxy)-2-hydroxy-propyl]-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]ammonium CAS Name: [(2S)-3-(3-ethylphenoxy)-2-hydroxypropyl]-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]ammonium IUPAC Name: [(2S)-3-(3-ethylphenoxy)-2-hydroxypropyl]-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]azanium Traditional Name: [(2S)-3-(3-ethylphenoxy)-2-hydroxy-propyl]-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]ammonium Formula: C18H32N2O2+2 MolecularWeight: 308.45888

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCC(C[NH2+]CC2CCC[NH+]2CC)O

Isomeric SMILES

CCC1=CC(=CC=C1)OC[C@H](C[NH2+]C[C@@H]2CCC[NH+]2CC)O

InChI

InChI=1S/C18H30N2O2/c1-3-15-7-5-9-18(11-15)22-14-17(21)13-19-12-16-8-6-10-20(16)4-2/h5,7,9,11,16-17,19,21H,3-4,6,8,10,12-14H2,1-2H3/p+2/t16-,17-/m0/s1