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9-(6-oxidanylidene-3,4,5-triphenyl-pyridazin-1-yl)nonanoic acid

9-(6-oxidanylidene-3,4,5-triphenyl-pyridazin-1-yl)nonanoic acid

Systemtic Name:9-(6-oxidanylidene-3,4,5-triphenyl-pyridazin-1-yl)nonanoic acid
Openeye Name:9-(6-oxo-3,4,5-triphenyl-pyridazin-1-yl)nonanoic acid
CAS Name:9-(6-oxo-3,4,5-triphenyl-1-pyridazinyl)nonanoic acid
IUPAC Name:9-(6-oxo-3,4,5-triphenylpyridazin-1-yl)nonanoic acid
Traditional Name:9-(6-keto-3,4,5-triphenyl-pyridazin-1-yl)pelargonic acid
Formula: C31H32N2O3
MolecularWeight: 480.59738
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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)CCCCCCCCC(=O)O)C4=CC=CC=C4


Isomeric SMILES

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


InChI

InChI=1S/C31H32N2O3/c34-27(35)22-14-3-1-2-4-15-23-33-31(36)29(25-18-10-6-11-19-25)28(24-16-8-5-9-17-24)30(32-33)26-20-12-7-13-21-26/h5-13,16-21H,1-4,14-15,22-23H2,(H,34,35)


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