4-[5-(ethylamino)-3-methyl-pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[5-(ethylamino)-3-methyl-pyrazol-1-yl]benzoic acid Openeye Name: 4-[5-(ethylamino)-3-methyl-pyrazol-1-yl]benzoic acid CAS Name: 4-[5-(ethylamino)-3-methyl-1-pyrazolyl]benzoic acid IUPAC Name: 4-[5-(ethylamino)-3-methylpyrazol-1-yl]benzoic acid Traditional Name: 4-[5-(ethylamino)-3-methyl-pyrazol-1-yl]benzoic acid Formula: C13H15N3O2 MolecularWeight: 245.2771

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC(=NN1C2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

CCNC1=CC(=NN1C2=CC=C(C=C2)C(=O)O)C

InChI

InChI=1S/C13H15N3O2/c1-3-14-12-8-9(2)15-16(12)11-6-4-10(5-7-11)13(17)18/h4-8,14H,3H2,1-2H3,(H,17,18)