[4-[(2-chlorophenyl)methoxy]-3-ethoxy-5-iodanyl-phenyl]methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: [4-[(2-chlorophenyl)methoxy]-3-ethoxy-5-iodanyl-phenyl]methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: [4-[(2-chlorophenyl)methoxy]-3-ethoxy-5-iodo-phenyl]methyl-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: [4-[(2-chlorophenyl)methoxy]-3-ethoxy-5-iodophenyl]methyl-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: [4-[(2-chlorophenyl)methoxy]-3-ethoxy-5-iodophenyl]methyl-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: [4-(2-chlorobenzyl)oxy-3-ethoxy-5-iodo-benzyl]-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C20H26ClINO3+ MolecularWeight: 490.78281

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]C(C)(C)CO)I)OCC2=CC=CC=C2Cl

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]C(C)(C)CO)I)OCC2=CC=CC=C2Cl

InChI

InChI=1S/C20H25ClINO3/c1-4-25-18-10-14(11-23-20(2,3)13-24)9-17(22)19(18)26-12-15-7-5-6-8-16(15)21/h5-10,23-24H,4,11-13H2,1-3H3/p+1