[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(2-cyanophenyl)benzoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(2-cyanophenyl)benzoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 2-(2-cyanophenyl)benzoate CAS Name: 2-(2-cyanophenyl)benzoic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 2-(2-cyanophenyl)benzoate Traditional Name: 2-(2-cyanophenyl)benzoic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=CC=CC=C1C2=CC=CC=C2C#N

Isomeric SMILES

CC(C)[C@H](C(=O)NC(=O)N)OC(=O)C1=CC=CC=C1C2=CC=CC=C2C#N

InChI

InChI=1S/C20H19N3O4/c1-12(2)17(18(24)23-20(22)26)27-19(25)16-10-6-5-9-15(16)14-8-4-3-7-13(14)11-21/h3-10,12,17H,1-2H3,(H3,22,23,24,26)/t17-/m1/s1