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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCC(CC2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCC(CC2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C20H24N4O3/c1-13-9-14(2)23-20(22-13)24-7-5-16(6-8-24)19(25)21-11-15-3-4-17-18(10-15)27-12-26-17/h3-4,9-10,16H,5-8,11-12H2,1-2H3,(H,21,25)