N-[2-(3,4-dimethoxyphenyl)ethyl]-1-pyrazin-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-pyrazin-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(pyrazine-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[oxo(2-pyrazinyl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(pyrazine-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-homoveratryl-1-pyrazinoyl-nipecotamide Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2CCCN(C2)C(=O)C3=NC=CN=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2CCCN(C2)C(=O)C3=NC=CN=C3)OC

InChI

InChI=1S/C21H26N4O4/c1-28-18-6-5-15(12-19(18)29-2)7-8-24-20(26)16-4-3-11-25(14-16)21(27)17-13-22-9-10-23-17/h5-6,9-10,12-13,16H,3-4,7-8,11,14H2,1-2H3,(H,24,26)