methyl 4-[3-(4-aminocarbonylphenyl)-1H-pyrazol-5-yl]benzoate

Systemtic Name: methyl 4-[3-(4-aminocarbonylphenyl)-1H-pyrazol-5-yl]benzoate Openeye Name: methyl 4-[3-(4-carbamoylphenyl)-1H-pyrazol-5-yl]benzoate CAS Name: 4-[3-(4-carbamoylphenyl)-1H-pyrazol-5-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(4-carbamoylphenyl)-1H-pyrazol-5-yl]benzoate Traditional Name: 4-[3-(4-carbamoylphenyl)-1H-pyrazol-5-yl]benzoic acid methyl ester Formula: C18H15N3O3 MolecularWeight: 321.33

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC(=NN2)C3=CC=C(C=C3)C(=O)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC(=NN2)C3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C18H15N3O3/c1-24-18(23)14-8-4-12(5-9-14)16-10-15(20-21-16)11-2-6-13(7-3-11)17(19)22/h2-10H,1H3,(H2,19,22)(H,20,21)