(2-ethoxyphenyl)methyl-[2-[[(2S)-2-oxidanylpropyl]azaniumyl]ethyl]azanium

Systemtic Name: (2-ethoxyphenyl)methyl-[2-[[(2S)-2-oxidanylpropyl]azaniumyl]ethyl]azanium Openeye Name: (2-ethoxyphenyl)methyl-[2-[[(2S)-2-hydroxypropyl]ammonio]ethyl]ammonium CAS Name: (2-ethoxyphenyl)methyl-[2-[[(2S)-2-hydroxypropyl]ammonio]ethyl]ammonium IUPAC Name: (2-ethoxyphenyl)methyl-[2-[[(2S)-2-hydroxypropyl]azaniumyl]ethyl]azanium Traditional Name: (2-ethoxybenzyl)-[2-[[(2S)-2-hydroxypropyl]ammonio]ethyl]ammonium Formula: C14H26N2O2+2 MolecularWeight: 254.36844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C[NH2+]CC[NH2+]CC(C)O

Isomeric SMILES

CCOC1=CC=CC=C1C[NH2+]CC[NH2+]C[C@H](C)O

InChI

InChI=1S/C14H24N2O2/c1-3-18-14-7-5-4-6-13(14)11-16-9-8-15-10-12(2)17/h4-7,12,15-17H,3,8-11H2,1-2H3/p+2/t12-/m0/s1