N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2S)-3-oxidanylidenepiperazin-2-yl]ethanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2S)-3-oxidanylidenepiperazin-2-yl]ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2S)-3-oxopiperazin-2-yl]acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2S)-3-oxo-2-piperazinyl]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[(2S)-3-oxopiperazin-2-yl]acetamide Traditional Name: N-homoveratryl-2-[(2S)-3-ketopiperazin-2-yl]acetamide Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CC2C(=O)NCCN2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C[C@H]2C(=O)NCCN2)OC

InChI

InChI=1S/C16H23N3O4/c1-22-13-4-3-11(9-14(13)23-2)5-6-18-15(20)10-12-16(21)19-8-7-17-12/h3-4,9,12,17H,5-8,10H2,1-2H3,(H,18,20)(H,19,21)/t12-/m0/s1