[4-(cyanomethoxy)-3-ethoxy-5-iodanyl-phenyl]methyl-phenethyl-azanium

Systemtic Name: [4-(cyanomethoxy)-3-ethoxy-5-iodanyl-phenyl]methyl-phenethyl-azanium Openeye Name: [4-(cyanomethoxy)-3-ethoxy-5-iodo-phenyl]methyl-phenethyl-ammonium CAS Name: [4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]methyl-phenethylammonium IUPAC Name: [4-(cyanomethoxy)-3-ethoxy-5-iodophenyl]methyl-phenethylazanium Traditional Name: [4-(cyanomethoxy)-3-ethoxy-5-iodo-benzyl]-phenethyl-ammonium Formula: C19H22IN2O2+ MolecularWeight: 437.29465

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CCC2=CC=CC=C2)I)OCC#N

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CCC2=CC=CC=C2)I)OCC#N

InChI

InChI=1S/C19H21IN2O2/c1-2-23-18-13-16(12-17(20)19(18)24-11-9-21)14-22-10-8-15-6-4-3-5-7-15/h3-7,12-13,22H,2,8,10-11,14H2,1H3/p+1