6-methyl-3-pentyl-1-phenyl-4H-pyridazine-4-carboxylic acid

Systemtic Name: 6-methyl-3-pentyl-1-phenyl-4H-pyridazine-4-carboxylic acid Openeye Name: 6-methyl-3-pentyl-1-phenyl-4H-pyridazine-4-carboxylic acid CAS Name: 6-methyl-3-pentyl-1-phenyl-4H-pyridazine-4-carboxylic acid IUPAC Name: 6-methyl-3-pentyl-1-phenyl-4H-pyridazine-4-carboxylic acid Traditional Name: 3-amyl-6-methyl-1-phenyl-4H-pyridazine-4-carboxylic acid Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN(C(=CC1C(=O)O)C)C2=CC=CC=C2

Isomeric SMILES

CCCCCC1=NN(C(=CC1C(=O)O)C)C2=CC=CC=C2

InChI

InChI=1S/C17H22N2O2/c1-3-4-6-11-16-15(17(20)21)12-13(2)19(18-16)14-9-7-5-8-10-14/h5,7-10,12,15H,3-4,6,11H2,1-2H3,(H,20,21)