[4-(2-hydroxyethyloxy)-3-methoxy-phenyl]methyl-[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: [4-(2-hydroxyethyloxy)-3-methoxy-phenyl]methyl-[(2S)-2-oxidanylpropyl]azanium Openeye Name: [4-(2-hydroxyethoxy)-3-methoxy-phenyl]methyl-[(2S)-2-hydroxypropyl]ammonium CAS Name: [4-(2-hydroxyethoxy)-3-methoxyphenyl]methyl-[(2S)-2-hydroxypropyl]ammonium IUPAC Name: [4-(2-hydroxyethoxy)-3-methoxyphenyl]methyl-[(2S)-2-hydroxypropyl]azanium Traditional Name: [4-(2-hydroxyethoxy)-3-methoxy-benzyl]-[(2S)-2-hydroxypropyl]ammonium Formula: C13H22NO4+ MolecularWeight: 256.31808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH2+]CC1=CC(=C(C=C1)OCCO)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C13H21NO4/c1-10(16)8-14-9-11-3-4-12(18-6-5-15)13(7-11)17-2/h3-4,7,10,14-16H,5-6,8-9H2,1-2H3/p+1/t10-/m0/s1