2-(3-phenylpyrazol-1-yl)cyclohexene-1-carboxylic acid

Systemtic Name: 2-(3-phenylpyrazol-1-yl)cyclohexene-1-carboxylic acid Openeye Name: 2-(3-phenylpyrazol-1-yl)cyclohexene-1-carboxylic acid CAS Name: 2-(3-phenyl-1-pyrazolyl)-1-cyclohexenecarboxylic acid IUPAC Name: 2-(3-phenylpyrazol-1-yl)cyclohexene-1-carboxylic acid Traditional Name: 2-(3-phenylpyrazol-1-yl)cyclohexene-1-carboxylic acid Formula: C16H16N2O2 MolecularWeight: 268.31044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C(C1)C(=O)O)N2C=CC(=N2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(=C(C1)C(=O)O)N2C=CC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H16N2O2/c19-16(20)13-8-4-5-9-15(13)18-11-10-14(17-18)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H,19,20)