(2-adamantylideneamino) 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate

Systemtic Name: (2-adamantylideneamino) 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Openeye Name: (2-adamantylideneamino) 5-methyl-3-phenyl-isoxazole-4-carboxylate CAS Name: 5-methyl-3-phenyl-4-isoxazolecarboxylic acid (2-adamantylideneamino) ester IUPAC Name: (2-adamantylideneamino) 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Traditional Name: 5-methyl-3-phenyl-isoxazole-4-carboxylic acid (2-adamantylideneamino) ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)ON=C3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)ON=C3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C21H22N2O3/c1-12-18(20(23-25-12)15-5-3-2-4-6-15)21(24)26-22-19-16-8-13-7-14(10-16)11-17(19)9-13/h2-6,13-14,16-17H,7-11H2,1H3