(5-ethanoyl-2-methoxy-phenyl)methyl 2-(1-adamantylcarbonylamino)ethanoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 2-(1-adamantylcarbonylamino)ethanoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 2-(adamantane-1-carbonylamino)acetate CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]acetic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 2-(adamantane-1-carbonylamino)acetate Traditional Name: 2-(adamantane-1-carbonylamino)acetic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C23H29NO5 MolecularWeight: 399.48006

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H29NO5/c1-14(25)18-3-4-20(28-2)19(8-18)13-29-21(26)12-24-22(27)23-9-15-5-16(10-23)7-17(6-15)11-23/h3-4,8,15-17H,5-7,9-13H2,1-2H3,(H,24,27)