[(1S)-2-oxidanylidene-1,2-diphenyl-ethyl] 4-(pyrazol-1-ylmethyl)benzoate

Systemtic Name: [(1S)-2-oxidanylidene-1,2-diphenyl-ethyl] 4-(pyrazol-1-ylmethyl)benzoate Openeye Name: [(1S)-2-oxo-1,2-diphenyl-ethyl] 4-(pyrazol-1-ylmethyl)benzoate CAS Name: 4-(1-pyrazolylmethyl)benzoic acid [(1S)-2-oxo-1,2-diphenylethyl] ester IUPAC Name: [(1S)-2-oxo-1,2-diphenylethyl] 4-(pyrazol-1-ylmethyl)benzoate Traditional Name: 4-(pyrazol-1-ylmethyl)benzoic acid [(1S)-2-keto-1,2-diphenyl-ethyl] ester Formula: C25H20N2O3 MolecularWeight: 396.4379

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)[C@@H](C(=O)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C25H20N2O3/c28-23(20-8-3-1-4-9-20)24(21-10-5-2-6-11-21)30-25(29)22-14-12-19(13-15-22)18-27-17-7-16-26-27/h1-17,24H,18H2/t24-/m0/s1