2-[1-[(2,3-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(4-oxidanylcyclohexyl)ethanamide

Systemtic Name: 2-[1-[(2,3-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(4-oxidanylcyclohexyl)ethanamide Openeye Name: 2-[1-[(2,3-dimethoxyphenyl)methyl]-3-oxo-piperazin-2-yl]-N-(4-hydroxycyclohexyl)acetamide CAS Name: 2-[1-[(2,3-dimethoxyphenyl)methyl]-3-oxo-2-piperazinyl]-N-(4-hydroxycyclohexyl)acetamide IUPAC Name: 2-[1-[(2,3-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl]-N-(4-hydroxycyclohexyl)acetamide Traditional Name: N-(4-hydroxycyclohexyl)-2-(3-keto-1-o-veratryl-piperazin-2-yl)acetamide Formula: C21H31N3O5 MolecularWeight: 405.48794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN2CCNC(=O)C2CC(=O)NC3CCC(CC3)O

Isomeric SMILES

COC1=CC=CC(=C1OC)CN2CCNC(=O)C2CC(=O)NC3CCC(CC3)O

InChI

InChI=1S/C21H31N3O5/c1-28-18-5-3-4-14(20(18)29-2)13-24-11-10-22-21(27)17(24)12-19(26)23-15-6-8-16(25)9-7-15/h3-5,15-17,25H,6-13H2,1-2H3,(H,22,27)(H,23,26)