2-[4-(3,5-dimethylpyrazol-1-yl)-4-oxidanylidene-butyl]benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[4-(3,5-dimethylpyrazol-1-yl)-4-oxidanylidene-butyl]benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[4-(3,5-dimethylpyrazol-1-yl)-4-oxo-butyl]benzo[de]isoquinoline-1,3-dione CAS Name: 2-[4-(3,5-dimethyl-1-pyrazolyl)-4-oxobutyl]benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[4-(3,5-dimethylpyrazol-1-yl)-4-oxobutyl]benzo[de]isoquinoline-1,3-dione Traditional Name: 2-[4-(3,5-dimethylpyrazol-1-yl)-4-keto-butyl]benzo[de]isoquinoline-1,3-quinone Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C

Isomeric SMILES

CC1=CC(=NN1C(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C

InChI

InChI=1S/C21H19N3O3/c1-13-12-14(2)24(22-13)18(25)10-5-11-23-20(26)16-8-3-6-15-7-4-9-17(19(15)16)21(23)27/h3-4,6-9,12H,5,10-11H2,1-2H3