(4-ethoxy-3-iodanyl-5-methoxy-phenyl)methyl-[(2R)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: (4-ethoxy-3-iodanyl-5-methoxy-phenyl)methyl-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: (4-ethoxy-3-iodo-5-methoxy-phenyl)methyl-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: (4-ethoxy-3-iodo-5-methoxyphenyl)methyl-[(2R)-1-hydroxybutan-2-yl]ammonium IUPAC Name: (4-ethoxy-3-iodo-5-methoxyphenyl)methyl-[(2R)-1-hydroxybutan-2-yl]azanium Traditional Name: (4-ethoxy-3-iodo-5-methoxy-benzyl)-[(1R)-1-methylolpropyl]ammonium Formula: C14H23INO3+ MolecularWeight: 380.24179

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]CC1=CC(=C(C(=C1)I)OCC)OC

Isomeric SMILES

CC[C@H](CO)[NH2+]CC1=CC(=C(C(=C1)I)OCC)OC

InChI

InChI=1S/C14H22INO3/c1-4-11(9-17)16-8-10-6-12(15)14(19-5-2)13(7-10)18-3/h6-7,11,16-17H,4-5,8-9H2,1-3H3/p+1/t11-/m1/s1