2-[4-[[(1-methylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-oxidanyl-pyrimidine-5-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-[4-[[(1-methylindol-3-yl)methylamino]methyl]piperidin-1-yl]-N-oxidanyl-pyrimidine-5-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-[4-[[(1-methylindol-3-yl)methylamino]methyl]-1-piperidyl]pyrimidine-5-carbohydroxamic acid; 2,2,2-trifluoroacetic acid CAS Name: N-hydroxy-2-[4-[[(1-methyl-3-indolyl)methylamino]methyl]-1-piperidinyl]-5-pyrimidinecarboxamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-hydroxy-2-[4-[[(1-methylindol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide; 2,2,2-trifluoroacetic acid Traditional Name: 2-[4-[[(1-methylindol-3-yl)methylamino]methyl]piperidino]pyrimidine-5-carbohydroxamic acid; 2,2,2-trifluoroacetic acid Formula: C23H27F3N6O4 MolecularWeight: 508.49349

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CNCC3CCN(CC3)C4=NC=C(C=N4)C(=O)NO.C(=O)(C(F)(F)F)O

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CNCC3CCN(CC3)C4=NC=C(C=N4)C(=O)NO.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C21H26N6O2.C2HF3O2/c1-26-14-17(18-4-2-3-5-19(18)26)11-22-10-15-6-8-27(9-7-15)21-23-12-16(13-24-21)20(28)25-29;3-2(4,5)1(6)7/h2-5,12-15,22,29H,6-11H2,1H3,(H,25,28);(H,6,7)