3-methyl-5-(4-methylpentoxy)-1-phenyl-pyrazole-4-carbaldehyde

Systemtic Name: 3-methyl-5-(4-methylpentoxy)-1-phenyl-pyrazole-4-carbaldehyde Openeye Name: 5-isohexyloxy-3-methyl-1-phenyl-pyrazole-4-carbaldehyde CAS Name: 3-methyl-5-(4-methylpentoxy)-1-phenyl-4-pyrazolecarboxaldehyde IUPAC Name: 3-methyl-5-(4-methylpentoxy)-1-phenylpyrazole-4-carbaldehyde Traditional Name: 5-isohexyloxy-3-methyl-1-phenyl-pyrazole-4-carbaldehyde Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=O)OCCCC(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C=O)OCCCC(C)C)C2=CC=CC=C2

InChI

InChI=1S/C17H22N2O2/c1-13(2)8-7-11-21-17-16(12-20)14(3)18-19(17)15-9-5-4-6-10-15/h4-6,9-10,12-13H,7-8,11H2,1-3H3