[(2R)-1-[[2-[(2R)-butan-2-yl]pyrazol-3-yl]amino]-1-oxidanylidene-propan-2-yl] 4-phenylbenzoate

Systemtic Name: [(2R)-1-[[2-[(2R)-butan-2-yl]pyrazol-3-yl]amino]-1-oxidanylidene-propan-2-yl] 4-phenylbenzoate Openeye Name: [(1R)-1-methyl-2-[[2-[(1R)-1-methylpropyl]pyrazol-3-yl]amino]-2-oxo-ethyl] 4-phenylbenzoate CAS Name: 4-phenylbenzoic acid [(2R)-1-[[2-[(2R)-butan-2-yl]-3-pyrazolyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[[2-[(2R)-butan-2-yl]pyrazol-3-yl]amino]-1-oxopropan-2-yl] 4-phenylbenzoate Traditional Name: 4-phenylbenzoic acid [(1R)-2-keto-1-methyl-2-[[2-[(1R)-1-methylpropyl]pyrazol-3-yl]amino]ethyl] ester Formula: C23H25N3O3 MolecularWeight: 391.4629

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=CC=N1)NC(=O)C(C)OC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C)N1C(=CC=N1)NC(=O)[C@@H](C)OC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H25N3O3/c1-4-16(2)26-21(14-15-24-26)25-22(27)17(3)29-23(28)20-12-10-19(11-13-20)18-8-6-5-7-9-18/h5-17H,4H2,1-3H3,(H,25,27)/t16-,17-/m1/s1