(E)-but-2-enedioic acid; 4-fluoranyl-N-methyl-N-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]benzamide

Systemtic Name: (E)-but-2-enedioic acid; 4-fluoranyl-N-methyl-N-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]benzamide Openeye Name: 4-fluoro-N-methyl-N-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]benzamide; fumaric acid CAS Name: (E)-2-butenedioic acid; 4-fluoro-N-methyl-N-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]benzamide IUPAC Name: (E)-but-2-enedioic acid; 4-fluoro-N-methyl-N-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]benzamide Traditional Name: 4-fluoro-N-methyl-N-[3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indol-5-yl]benzamide; fumaric acid Formula: C25H24FN3O5 MolecularWeight: 465.473563

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC2=C(C=C1)NC=C2C3=CCNCC3)C(=O)C4=CC=C(C=C4)F.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(C1=CC2=C(C=C1)NC=C2C3=CCNCC3)C(=O)C4=CC=C(C=C4)F.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C21H20FN3O.C4H4O4/c1-25(21(26)15-2-4-16(22)5-3-15)17-6-7-20-18(12-17)19(13-24-20)14-8-10-23-11-9-14;5-3(6)1-2-4(7)8/h2-8,12-13,23-24H,9-11H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+