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

Systemtic Name: N-(2-adamantyl)-2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-2-yl]ethanamide Openeye Name: N-(2-adamantyl)-2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-piperazin-2-yl]acetamide CAS Name: N-(2-adamantyl)-2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-2-piperazinyl]acetamide IUPAC Name: N-(2-adamantyl)-2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxopiperazin-2-yl]acetamide Traditional Name: N-(2-adamantyl)-2-[(2R)-3-keto-1-veratryl-piperazin-2-yl]acetamide Formula: C25H35N3O4 MolecularWeight: 441.5631

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCNC(=O)C2CC(=O)NC3C4CC5CC(C4)CC3C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCNC(=O)[C@H]2CC(=O)NC3C4CC5CC(C4)CC3C5)OC

InChI

InChI=1S/C25H35N3O4/c1-31-21-4-3-15(12-22(21)32-2)14-28-6-5-26-25(30)20(28)13-23(29)27-24-18-8-16-7-17(10-18)11-19(24)9-16/h3-4,12,16-20,24H,5-11,13-14H2,1-2H3,(H,26,30)(H,27,29)/t16?,17?,18?,19?,20-,24?/m1/s1