N-[9,10-bis(oxidanylidene)anthracen-1-yl]-5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-1-yl]-5-chloranyl-3-methyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-(9,10-dioxo-1-anthryl)-3-methyl-1-phenyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-(9,10-dioxo-1-anthracenyl)-3-methyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-(9,10-dioxoanthracen-1-yl)-3-methyl-1-phenylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-(9,10-diketo-1-anthryl)-3-methyl-1-phenyl-pyrazole-4-carboxamide Formula: C25H16ClN3O3 MolecularWeight: 441.86584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)Cl)C5=CC=CC=C5

InChI

InChI=1S/C25H16ClN3O3/c1-14-20(24(26)29(28-14)15-8-3-2-4-9-15)25(32)27-19-13-7-12-18-21(19)23(31)17-11-6-5-10-16(17)22(18)30/h2-13H,1H3,(H,27,32)