3-(4-ethoxynaphthalen-1-yl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-(4-ethoxynaphthalen-1-yl)-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(4-ethoxy-1-naphthyl)-1H-pyrazole-5-carboxylic acid CAS Name: 3-(4-ethoxy-1-naphthalenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-(4-ethoxynaphthalen-1-yl)-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(4-ethoxy-1-naphthyl)-1H-pyrazole-5-carboxylic acid Formula: C16H14N2O3 MolecularWeight: 282.29396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C2=CC=CC=C21)C3=NNC(=C3)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C2=CC=CC=C21)C3=NNC(=C3)C(=O)O

InChI

InChI=1S/C16H14N2O3/c1-2-21-15-8-7-11(10-5-3-4-6-12(10)15)13-9-14(16(19)20)18-17-13/h3-9H,2H2,1H3,(H,17,18)(H,19,20)