(3-ethoxy-5-iodanyl-4-phenylmethoxy-phenyl)methyl-(2-hydroxyethyl)azanium

Systemtic Name: (3-ethoxy-5-iodanyl-4-phenylmethoxy-phenyl)methyl-(2-hydroxyethyl)azanium Openeye Name: (4-benzyloxy-3-ethoxy-5-iodo-phenyl)methyl-(2-hydroxyethyl)ammonium CAS Name: (3-ethoxy-5-iodo-4-phenylmethoxyphenyl)methyl-(2-hydroxyethyl)ammonium IUPAC Name: (3-ethoxy-5-iodo-4-phenylmethoxyphenyl)methyl-(2-hydroxyethyl)azanium Traditional Name: (4-benzoxy-3-ethoxy-5-iodo-benzyl)-(2-hydroxyethyl)ammonium Formula: C18H23INO3+ MolecularWeight: 428.28459

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CCO)I)OCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CCO)I)OCC2=CC=CC=C2

InChI

InChI=1S/C18H22INO3/c1-2-22-17-11-15(12-20-8-9-21)10-16(19)18(17)23-13-14-6-4-3-5-7-14/h3-7,10-11,20-21H,2,8-9,12-13H2,1H3/p+1