2-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-isoquinoline-1,3-dione

Systemtic Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-isoquinoline-1,3-dione Openeye Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-isoquinoline-1,3-dione CAS Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-isoquinoline-1,3-dione IUPAC Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-isoquinoline-1,3-dione Traditional Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-isoquinoline-1,3-quinone Formula: C14H13N3O2 MolecularWeight: 255.27192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)N2C(=O)CC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=C(C(=NN1)C)N2C(=O)CC3=CC=CC=C3C2=O

InChI

InChI=1S/C14H13N3O2/c1-8-13(9(2)16-15-8)17-12(18)7-10-5-3-4-6-11(10)14(17)19/h3-6H,7H2,1-2H3,(H,15,16)