2-[4-(3,5-dimethylpyrazol-1-yl)-3-methoxy-phenyl]-6-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-[4-(3,5-dimethylpyrazol-1-yl)-3-methoxy-phenyl]-6-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-[4-(3,5-dimethylpyrazol-1-yl)-3-methoxy-phenyl]-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-[4-(3,5-dimethyl-1-pyrazolyl)-3-methoxyphenyl]-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-[4-(3,5-dimethylpyrazol-1-yl)-3-methoxyphenyl]-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-[4-(3,5-dimethylpyrazol-1-yl)-3-methoxy-phenyl]-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C24H18N4O5 MolecularWeight: 442.42352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(C=C(C=C2)N3C(=O)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=C5C3=O)OC)C

Isomeric SMILES

CC1=CC(=NN1C2=C(C=C(C=C2)N3C(=O)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC=C5C3=O)OC)C

InChI

InChI=1S/C24H18N4O5/c1-13-11-14(2)27(25-13)20-9-7-15(12-21(20)33-3)26-23(29)17-6-4-5-16-19(28(31)32)10-8-18(22(16)17)24(26)30/h4-12H,1-3H3