(E)-but-2-enedioic acid; 1-(4-fluorophenyl)-3-(6-iodanylnaphthalen-1-yl)oxy-N-methyl-propan-1-amine

Systemtic Name: (E)-but-2-enedioic acid; 1-(4-fluorophenyl)-3-(6-iodanylnaphthalen-1-yl)oxy-N-methyl-propan-1-amine Openeye Name: 1-(4-fluorophenyl)-3-[(6-iodo-1-naphthyl)oxy]-N-methyl-propan-1-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; 1-(4-fluorophenyl)-3-[(6-iodo-1-naphthalenyl)oxy]-N-methyl-1-propanamine IUPAC Name: (E)-but-2-enedioic acid; 1-(4-fluorophenyl)-3-(6-iodonaphthalen-1-yl)oxy-N-methylpropan-1-amine Traditional Name: [1-(4-fluorophenyl)-3-(6-iodo-1-naphthoxy)propyl]-methyl-amine; fumaric acid Formula: C24H23FINO5 MolecularWeight: 551.345993

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CCOC1=CC=CC2=C1C=CC(=C2)I)C3=CC=C(C=C3)F.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CNC(CCOC1=CC=CC2=C1C=CC(=C2)I)C3=CC=C(C=C3)F.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C20H19FINO.C4H4O4/c1-23-19(14-5-7-16(21)8-6-14)11-12-24-20-4-2-3-15-13-17(22)9-10-18(15)20;5-3(6)1-2-4(7)8/h2-10,13,19,23H,11-12H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+