(4-cyclopentyloxy-3-iodanyl-5-methoxy-phenyl)methyl-(2-hydroxyethyl)azanium

Systemtic Name: (4-cyclopentyloxy-3-iodanyl-5-methoxy-phenyl)methyl-(2-hydroxyethyl)azanium Openeye Name: [4-(cyclopentoxy)-3-iodo-5-methoxy-phenyl]methyl-(2-hydroxyethyl)ammonium CAS Name: (4-cyclopentyloxy-3-iodo-5-methoxyphenyl)methyl-(2-hydroxyethyl)ammonium IUPAC Name: (4-cyclopentyloxy-3-iodo-5-methoxyphenyl)methyl-(2-hydroxyethyl)azanium Traditional Name: [4-(cyclopentoxy)-3-iodo-5-methoxy-benzyl]-(2-hydroxyethyl)ammonium Formula: C15H23INO3+ MolecularWeight: 392.25249

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CCO)I)OC2CCCC2

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CCO)I)OC2CCCC2

InChI

InChI=1S/C15H22INO3/c1-19-14-9-11(10-17-6-7-18)8-13(16)15(14)20-12-4-2-3-5-12/h8-9,12,17-18H,2-7,10H2,1H3/p+1