3-(5-azanyl-1,3-dimethyl-pyrazol-4-yl)-3H-2-benzofuran-1-one

Systemtic Name: 3-(5-azanyl-1,3-dimethyl-pyrazol-4-yl)-3H-2-benzofuran-1-one Openeye Name: 3-(5-amino-1,3-dimethyl-pyrazol-4-yl)-3H-isobenzofuran-1-one CAS Name: 3-(5-amino-1,3-dimethyl-4-pyrazolyl)-3H-isobenzofuran-1-one IUPAC Name: 3-(5-amino-1,3-dimethylpyrazol-4-yl)-3H-2-benzofuran-1-one Traditional Name: 3-(5-amino-1,3-dimethyl-pyrazol-4-yl)phthalide Formula: C13H13N3O2 MolecularWeight: 243.26122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2C3=CC=CC=C3C(=O)O2)N)C

Isomeric SMILES

CC1=NN(C(=C1C2C3=CC=CC=C3C(=O)O2)N)C

InChI

InChI=1S/C13H13N3O2/c1-7-10(12(14)16(2)15-7)11-8-5-3-4-6-9(8)13(17)18-11/h3-6,11H,14H2,1-2H3