(3R)-N-(1,3-benzodioxol-5-ylmethyl)-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide

Systemtic Name: (3R)-N-(1,3-benzodioxol-5-ylmethyl)-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide Openeye Name: (3R)-N-(1,3-benzodioxol-5-ylmethyl)-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide CAS Name: (3R)-N-(1,3-benzodioxol-5-ylmethyl)-1-(4,6-dimethyl-2-pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: (3R)-N-(1,3-benzodioxol-5-ylmethyl)-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide Traditional Name: (3R)-1-(4,6-dimethylpyrimidin-2-yl)-N-piperonyl-nipecotamide Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCCC(C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCC[C@H](C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C20H24N4O3/c1-13-8-14(2)23-20(22-13)24-7-3-4-16(11-24)19(25)21-10-15-5-6-17-18(9-15)27-12-26-17/h5-6,8-9,16H,3-4,7,10-12H2,1-2H3,(H,21,25)/t16-/m1/s1