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

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 3-acetamidobenzoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C15H19N3O5 MolecularWeight: 321.32846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=CC(=CC=C1)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O5/c1-8(2)12(13(20)18-15(16)22)23-14(21)10-5-4-6-11(7-10)17-9(3)19/h4-8,12H,1-3H3,(H,17,19)(H3,16,18,20,22)/t12-/m1/s1