6-[4-(9-methyldecyl)phenyl]pyridazine-3-carboxylic acid

Systemtic Name: 6-[4-(9-methyldecyl)phenyl]pyridazine-3-carboxylic acid Openeye Name: 6-[4-(9-methyldecyl)phenyl]pyridazine-3-carboxylic acid CAS Name: 6-[4-(9-methyldecyl)phenyl]-3-pyridazinecarboxylic acid IUPAC Name: 6-[4-(9-methyldecyl)phenyl]pyridazine-3-carboxylic acid Traditional Name: 6-[4-(9-methyldecyl)phenyl]pyridazine-3-carboxylic acid Formula: C22H30N2O2 MolecularWeight: 354.4858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCC1=CC=C(C=C1)C2=NN=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)CCCCCCCCC1=CC=C(C=C1)C2=NN=C(C=C2)C(=O)O

InChI

InChI=1S/C22H30N2O2/c1-17(2)9-7-5-3-4-6-8-10-18-11-13-19(14-12-18)20-15-16-21(22(25)26)24-23-20/h11-17H,3-10H2,1-2H3,(H,25,26)