ethanedioic acid; N-[[1-(4-fluorophenyl)-3,5-dimethyl-pyrazol-4-yl]methyl]-2-(1H-indol-3-yl)ethanamine

Systemtic Name: ethanedioic acid; N-[[1-(4-fluorophenyl)-3,5-dimethyl-pyrazol-4-yl]methyl]-2-(1H-indol-3-yl)ethanamine Openeye Name: N-[[1-(4-fluorophenyl)-3,5-dimethyl-pyrazol-4-yl]methyl]-2-(1H-indol-3-yl)ethanamine; oxalic acid CAS Name: N-[[1-(4-fluorophenyl)-3,5-dimethyl-4-pyrazolyl]methyl]-2-(1H-indol-3-yl)ethanamine; oxalic acid IUPAC Name: N-[[1-(4-fluorophenyl)-3,5-dimethylpyrazol-4-yl]methyl]-2-(1H-indol-3-yl)ethanamine; oxalic acid Traditional Name: [1-(4-fluorophenyl)-3,5-dimethyl-pyrazol-4-yl]methyl-[2-(1H-indol-3-yl)ethyl]amine; oxalic acid Formula: C24H25FN4O4 MolecularWeight: 452.478103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)CNCCC3=CNC4=CC=CC=C43.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)CNCCC3=CNC4=CC=CC=C43.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H23FN4.C2H2O4/c1-15-21(16(2)27(26-15)19-9-7-18(23)8-10-19)14-24-12-11-17-13-25-22-6-4-3-5-20(17)22;3-1(4)2(5)6/h3-10,13,24-25H,11-12,14H2,1-2H3;(H,3,4)(H,5,6)