N-[2-(2,5-dimethoxyphenyl)ethyl]-4-pyridin-3-ylcarbonyl-piperazine-2-carboxamide

Systemtic Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-4-pyridin-3-ylcarbonyl-piperazine-2-carboxamide Openeye Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-4-(pyridine-3-carbonyl)piperazine-2-carboxamide CAS Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-4-[oxo(3-pyridinyl)methyl]-2-piperazinecarboxamide IUPAC Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-4-(pyridine-3-carbonyl)piperazine-2-carboxamide Traditional Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-4-nicotinoyl-piperazine-2-carboxamide Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CCNC(=O)C2CN(CCN2)C(=O)C3=CN=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CCNC(=O)C2CN(CCN2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H26N4O4/c1-28-17-5-6-19(29-2)15(12-17)7-9-24-20(26)18-14-25(11-10-23-18)21(27)16-4-3-8-22-13-16/h3-6,8,12-13,18,23H,7,9-11,14H2,1-2H3,(H,24,26)