5-[furan-2-ylmethyl(methyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[furan-2-ylmethyl(methyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 5-[2-furylmethyl(methyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid CAS Name: 5-[2-furanylmethyl(methyl)amino]-1,3-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[furan-2-ylmethyl(methyl)amino]-1,3-dimethylpyrazole-4-carboxylic acid Traditional Name: 5-[2-furfuryl(methyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid Formula: C12H15N3O3 MolecularWeight: 249.2658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)N(C)CC2=CC=CO2)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)N(C)CC2=CC=CO2)C

InChI

InChI=1S/C12H15N3O3/c1-8-10(12(16)17)11(15(3)13-8)14(2)7-9-5-4-6-18-9/h4-6H,7H2,1-3H3,(H,16,17)