[2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-(3-oxidanyl-1-adamantyl)ethanoate

Systemtic Name: [2-[(2,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] 2-(3-oxidanyl-1-adamantyl)ethanoate Openeye Name: [2-(2,5-dimethoxyanilino)-2-oxo-ethyl] 2-(3-hydroxy-1-adamantyl)acetate CAS Name: 2-(3-hydroxy-1-adamantyl)acetic acid [2-(2,5-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethoxyanilino)-2-oxoethyl] 2-(3-hydroxy-1-adamantyl)acetate Traditional Name: 2-(3-hydroxy-1-adamantyl)acetic acid [2-(2,5-dimethoxyanilino)-2-keto-ethyl] ester Formula: C22H29NO6 MolecularWeight: 403.46876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)COC(=O)CC23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)COC(=O)CC23CC4CC(C2)CC(C4)(C3)O

InChI

InChI=1S/C22H29NO6/c1-27-16-3-4-18(28-2)17(6-16)23-19(24)12-29-20(25)11-21-7-14-5-15(8-21)10-22(26,9-14)13-21/h3-4,6,14-15,26H,5,7-13H2,1-2H3,(H,23,24)