(3R)-N-(1,3-benzodioxol-5-yl)-1-pyrimidin-2-yl-piperidine-3-carboxamide

Systemtic Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-pyrimidin-2-yl-piperidine-3-carboxamide Openeye Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-pyrimidin-2-yl-piperidine-3-carboxamide CAS Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-(2-pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-pyrimidin-2-ylpiperidine-3-carboxamide Traditional Name: (3R)-N-(1,3-benzodioxol-5-yl)-1-(2-pyrimidyl)nipecotamide Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C[C@H](CN(C1)C2=NC=CC=N2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H18N4O3/c22-16(20-13-4-5-14-15(9-13)24-11-23-14)12-3-1-8-21(10-12)17-18-6-2-7-19-17/h2,4-7,9,12H,1,3,8,10-11H2,(H,20,22)/t12-/m1/s1