(5-chloranyl-2-methoxy-phenyl)methyl 2-[2-(1-adamantyl)ethanoylamino]ethanoate

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl 2-[2-(1-adamantyl)ethanoylamino]ethanoate Openeye Name: (5-chloro-2-methoxy-phenyl)methyl 2-[[2-(1-adamantyl)acetyl]amino]acetate CAS Name: 2-[[2-(1-adamantyl)-1-oxoethyl]amino]acetic acid (5-chloro-2-methoxyphenyl)methyl ester IUPAC Name: (5-chloro-2-methoxyphenyl)methyl 2-[[2-(1-adamantyl)acetyl]amino]acetate Traditional Name: 2-[[2-(1-adamantyl)acetyl]amino]acetic acid (5-chloro-2-methoxy-benzyl) ester Formula: C22H28ClNO4 MolecularWeight: 405.91502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)COC(=O)CNC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)COC(=O)CNC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H28ClNO4/c1-27-19-3-2-18(23)7-17(19)13-28-21(26)12-24-20(25)11-22-8-14-4-15(9-22)6-16(5-14)10-22/h2-3,7,14-16H,4-6,8-13H2,1H3,(H,24,25)