butyl-[(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)methyl]-(phenylmethyl)azanium

Systemtic Name: butyl-[(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-butyl-[(4-hydroxy-3-iodo-5-methoxy-phenyl)methyl]ammonium CAS Name: butyl-[(4-hydroxy-3-iodo-5-methoxyphenyl)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-butyl-[(4-hydroxy-3-iodo-5-methoxyphenyl)methyl]azanium Traditional Name: benzyl-butyl-(4-hydroxy-3-iodo-5-methoxy-benzyl)ammonium Formula: C19H25INO2+ MolecularWeight: 426.31177

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=CC=CC=C1)CC2=CC(=C(C(=C2)I)O)OC

Isomeric SMILES

CCCC[NH+](CC1=CC=CC=C1)CC2=CC(=C(C(=C2)I)O)OC

InChI

InChI=1S/C19H24INO2/c1-3-4-10-21(13-15-8-6-5-7-9-15)14-16-11-17(20)19(22)18(12-16)23-2/h5-9,11-12,22H,3-4,10,13-14H2,1-2H3/p+1