N-oxidanyl-2-[4-[[[(E)-1-oxidanyl-4-phenyl-but-3-en-2-yl]amino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide

Systemtic Name: N-oxidanyl-2-[4-[[[(E)-1-oxidanyl-4-phenyl-but-3-en-2-yl]amino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide Openeye Name: 2-[4-[[[(E)-1-(hydroxymethyl)-3-phenyl-allyl]amino]methyl]-1-piperidyl]pyrimidine-5-carbohydroxamic acid CAS Name: N-hydroxy-2-[4-[[[(E)-1-hydroxy-4-phenylbut-3-en-2-yl]amino]methyl]-1-piperidinyl]-5-pyrimidinecarboxamide IUPAC Name: N-hydroxy-2-[4-[[[(E)-1-hydroxy-4-phenylbut-3-en-2-yl]amino]methyl]piperidin-1-yl]pyrimidine-5-carboxamide Traditional Name: 2-[4-[[[(E)-1-methylol-3-phenyl-allyl]amino]methyl]piperidino]pyrimidine-5-carbohydroxamic acid Formula: C21H27N5O3 MolecularWeight: 397.47078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC(CO)C=CC2=CC=CC=C2)C3=NC=C(C=N3)C(=O)NO

Isomeric SMILES

C1CN(CCC1CNC(CO)/C=C/C2=CC=CC=C2)C3=NC=C(C=N3)C(=O)NO

InChI

InChI=1S/C21H27N5O3/c27-15-19(7-6-16-4-2-1-3-5-16)22-12-17-8-10-26(11-9-17)21-23-13-18(14-24-21)20(28)25-29/h1-7,13-14,17,19,22,27,29H,8-12,15H2,(H,25,28)/b7-6+