3-methyl-4-[(4-methylphenyl)methyl]-4-oxidanyl-1,2-oxazol-5-one

Systemtic Name: 3-methyl-4-[(4-methylphenyl)methyl]-4-oxidanyl-1,2-oxazol-5-one Openeye Name: 4-hydroxy-3-methyl-4-(p-tolylmethyl)isoxazol-5-one CAS Name: 4-hydroxy-3-methyl-4-[(4-methylphenyl)methyl]-5-isoxazolone IUPAC Name: 4-hydroxy-3-methyl-4-[(4-methylphenyl)methyl]-1,2-oxazol-5-one Traditional Name: 4-hydroxy-3-methyl-4-(4-methylbenzyl)-2-isoxazolin-5-one Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2(C(=NOC2=O)C)O

Isomeric SMILES

CC1=CC=C(C=C1)CC2(C(=NOC2=O)C)O

InChI

InChI=1S/C12H13NO3/c1-8-3-5-10(6-4-8)7-12(15)9(2)13-16-11(12)14/h3-6,15H,7H2,1-2H3