7-[(5E)-5-[[2-(4-tert-butylphenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,3-dien-1-yl]-4-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 7-[(5E)-5-[[2-(4-tert-butylphenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]hydrazinylidene]-6-oxidanylidene-cyclohexa-1,3-dien-1-yl]-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 7-[(5E)-5-[[2-(4-tert-butylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]hydrazono]-6-oxo-cyclohexa-1,3-dien-1-yl]-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 7-[(5E)-5-[[2-(4-tert-butylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]hydrazinylidene]-6-oxo-1-cyclohexa-1,3-dienyl]-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 7-[(5E)-5-[[2-(4-tert-butylphenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]hydrazinylidene]-6-oxocyclohexa-1,3-dien-1-yl]-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 7-[(5E)-5-[[1-(4-tert-butylphenyl)-5-keto-3-methyl-3-pyrazolin-4-yl]hydrazono]-6-keto-cyclohexa-1,3-dien-1-yl]-4-keto-1H-quinoline-3-carboxylic acid Formula: C30H27N5O5 MolecularWeight: 537.56588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)C(C)(C)C)NN=C3C=CC=C(C3=O)C4=CC5=C(C=C4)C(=O)C(=CN5)C(=O)O

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=C(C=C2)C(C)(C)C)N/N=C/3\C=CC=C(C3=O)C4=CC5=C(C=C4)C(=O)C(=CN5)C(=O)O

InChI

InChI=1S/C30H27N5O5/c1-16-25(28(38)35(34-16)19-11-9-18(10-12-19)30(2,3)4)33-32-23-7-5-6-20(27(23)37)17-8-13-21-24(14-17)31-15-22(26(21)36)29(39)40/h5-15,33-34H,1-4H3,(H,31,36)(H,39,40)/b32-23+