4-(6-oxidanylidene-3,4,5-triphenyl-pyridazin-1-yl)butanoic acid

Systemtic Name: 4-(6-oxidanylidene-3,4,5-triphenyl-pyridazin-1-yl)butanoic acid Openeye Name: 4-(6-oxo-3,4,5-triphenyl-pyridazin-1-yl)butanoic acid CAS Name: 4-(6-oxo-3,4,5-triphenyl-1-pyridazinyl)butanoic acid IUPAC Name: 4-(6-oxo-3,4,5-triphenylpyridazin-1-yl)butanoic acid Traditional Name: 4-(6-keto-3,4,5-triphenyl-pyridazin-1-yl)butyric acid Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)N(N=C2C3=CC=CC=C3)CCCC(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)N(N=C2C3=CC=CC=C3)CCCC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C26H22N2O3/c29-22(30)17-10-18-28-26(31)24(20-13-6-2-7-14-20)23(19-11-4-1-5-12-19)25(27-28)21-15-8-3-9-16-21/h1-9,11-16H,10,17-18H2,(H,29,30)