N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(3-methylbutanoyl)piperazin-2-yl]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(3-methylbutanoyl)piperazin-2-yl]ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(3-methylbutanoyl)piperazin-2-yl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(3-methyl-1-oxobutyl)-2-piperazinyl]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(3-methylbutanoyl)piperazin-2-yl]acetamide Traditional Name: N-homoveratryl-2-(4-isovalerylpiperazin-2-yl)acetamide Formula: C21H33N3O4 MolecularWeight: 391.50442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCNC(C1)CC(=O)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)CC(=O)N1CCNC(C1)CC(=O)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H33N3O4/c1-15(2)11-21(26)24-10-9-22-17(14-24)13-20(25)23-8-7-16-5-6-18(27-3)19(12-16)28-4/h5-6,12,15,17,22H,7-11,13-14H2,1-4H3,(H,23,25)