(5-methyl-1,2-oxazol-3-yl)methyl 4-(1-adamantylcarbonylamino)benzoate

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl 4-(1-adamantylcarbonylamino)benzoate Openeye Name: (5-methylisoxazol-3-yl)methyl 4-(adamantane-1-carbonylamino)benzoate CAS Name: 4-[[1-adamantyl(oxo)methyl]amino]benzoic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl 4-(adamantane-1-carbonylamino)benzoate Traditional Name: 4-(adamantane-1-carbonylamino)benzoic acid (5-methylisoxazol-3-yl)methyl ester Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)COC(=O)C2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=NO1)COC(=O)C2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H26N2O4/c1-14-6-20(25-29-14)13-28-21(26)18-2-4-19(5-3-18)24-22(27)23-10-15-7-16(11-23)9-17(8-15)12-23/h2-6,15-17H,7-13H2,1H3,(H,24,27)