[3-iodanyl-5-methoxy-4-(2-methoxy-2-oxidanylidene-ethoxy)phenyl]methyl-phenethyl-azanium

Systemtic Name: [3-iodanyl-5-methoxy-4-(2-methoxy-2-oxidanylidene-ethoxy)phenyl]methyl-phenethyl-azanium Openeye Name: [3-iodo-5-methoxy-4-(2-methoxy-2-oxo-ethoxy)phenyl]methyl-phenethyl-ammonium CAS Name: [3-iodo-5-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]methyl-phenethylammonium IUPAC Name: [3-iodo-5-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]methyl-phenethylazanium Traditional Name: [3-iodo-4-(2-keto-2-methoxy-ethoxy)-5-methoxy-benzyl]-phenethyl-ammonium Formula: C19H23INO4+ MolecularWeight: 456.29469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CCC2=CC=CC=C2)I)OCC(=O)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CCC2=CC=CC=C2)I)OCC(=O)OC

InChI

InChI=1S/C19H22INO4/c1-23-17-11-15(10-16(20)19(17)25-13-18(22)24-2)12-21-9-8-14-6-4-3-5-7-14/h3-7,10-11,21H,8-9,12-13H2,1-2H3/p+1