2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(1-ethyl-3,5-dimethyl-4-pyrazolyl)-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(1-ethyl-3,5-dimethylpyrazol-4-yl)-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C19H16N4O4 MolecularWeight: 364.35474

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)N2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)N2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O)C

InChI

InChI=1S/C19H16N4O4/c1-4-21-11(3)17(10(2)20-21)22-18(24)13-7-5-6-12-15(23(26)27)9-8-14(16(12)13)19(22)25/h5-9H,4H2,1-3H3