N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,6-dimethyl-2-pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-N-homoveratryl-nipecotamide Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCCC(C2)C(=O)NCCC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCCC(C2)C(=O)NCCC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C22H30N4O3/c1-15-12-16(2)25-22(24-15)26-11-5-6-18(14-26)21(27)23-10-9-17-7-8-19(28-3)20(13-17)29-4/h7-8,12-13,18H,5-6,9-11,14H2,1-4H3,(H,23,27)