N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide Formula: C20H26ClNO4 MolecularWeight: 379.87774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CC23CC4CC(C2)CC(C4)(C3)O)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CC23C[C@H]4C[C@@H](C2)CC(C4)(C3)O)OC)Cl

InChI

InChI=1S/C20H26ClNO4/c1-25-16-5-15(17(26-2)4-14(16)21)22-18(23)10-19-6-12-3-13(7-19)9-20(24,8-12)11-19/h4-5,12-13,24H,3,6-11H2,1-2H3,(H,22,23)/t12-,13+,19?,20?