4-(1,3-benzoxazol-2-ylmethyl)-5-methyl-1,2-dihydropyrazol-3-one

Systemtic Name: 4-(1,3-benzoxazol-2-ylmethyl)-5-methyl-1,2-dihydropyrazol-3-one Openeye Name: 4-(1,3-benzoxazol-2-ylmethyl)-5-methyl-1,2-dihydropyrazol-3-one CAS Name: 4-(1,3-benzoxazol-2-ylmethyl)-5-methyl-1,2-dihydropyrazol-3-one IUPAC Name: 4-(1,3-benzoxazol-2-ylmethyl)-5-methyl-1,2-dihydropyrazol-3-one Traditional Name: 4-(1,3-benzoxazol-2-ylmethyl)-5-methyl-3-pyrazolin-3-one Formula: C12H11N3O2 MolecularWeight: 229.23464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)CC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC1=C(C(=O)NN1)CC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C12H11N3O2/c1-7-8(12(16)15-14-7)6-11-13-9-4-2-3-5-10(9)17-11/h2-5H,6H2,1H3,(H2,14,15,16)