(5-chloranyl-2-ethoxy-phenyl)methyl-[2-[[(2S)-2-oxidanylpropyl]azaniumyl]ethyl]azanium

Systemtic Name: (5-chloranyl-2-ethoxy-phenyl)methyl-[2-[[(2S)-2-oxidanylpropyl]azaniumyl]ethyl]azanium Openeye Name: (5-chloro-2-ethoxy-phenyl)methyl-[2-[[(2S)-2-hydroxypropyl]ammonio]ethyl]ammonium CAS Name: (5-chloro-2-ethoxyphenyl)methyl-[2-[[(2S)-2-hydroxypropyl]ammonio]ethyl]ammonium IUPAC Name: (5-chloro-2-ethoxyphenyl)methyl-[2-[[(2S)-2-hydroxypropyl]azaniumyl]ethyl]azanium Traditional Name: (5-chloro-2-ethoxy-benzyl)-[2-[[(2S)-2-hydroxypropyl]ammonio]ethyl]ammonium Formula: C14H25ClN2O2+2 MolecularWeight: 288.8135

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C[NH2+]CC[NH2+]CC(C)O

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C[NH2+]CC[NH2+]C[C@H](C)O

InChI

InChI=1S/C14H23ClN2O2/c1-3-19-14-5-4-13(15)8-12(14)10-17-7-6-16-9-11(2)18/h4-5,8,11,16-18H,3,6-7,9-10H2,1-2H3/p+2/t11-/m0/s1