(E)-but-2-enedioic acid; 3-[5-chloranyl-1-(4-fluorophenyl)indol-3-yl]-N,N-dimethyl-propan-1-amine

Systemtic Name: (E)-but-2-enedioic acid; 3-[5-chloranyl-1-(4-fluorophenyl)indol-3-yl]-N,N-dimethyl-propan-1-amine Openeye Name: 3-[5-chloro-1-(4-fluorophenyl)indol-3-yl]-N,N-dimethyl-propan-1-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; 3-[5-chloro-1-(4-fluorophenyl)-3-indolyl]-N,N-dimethyl-1-propanamine IUPAC Name: (E)-but-2-enedioic acid; 3-[5-chloro-1-(4-fluorophenyl)indol-3-yl]-N,N-dimethylpropan-1-amine Traditional Name: 3-[5-chloro-1-(4-fluorophenyl)indol-3-yl]propyl-dimethyl-amine; fumaric acid Formula: C23H24ClFN2O4 MolecularWeight: 446.899063

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC1=CN(C2=C1C=C(C=C2)Cl)C3=CC=C(C=C3)F.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(C)CCCC1=CN(C2=C1C=C(C=C2)Cl)C3=CC=C(C=C3)F.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C19H20ClFN2.C4H4O4/c1-22(2)11-3-4-14-13-23(17-8-6-16(21)7-9-17)19-10-5-15(20)12-18(14)19;5-3(6)1-2-4(7)8/h5-10,12-13H,3-4,11H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+