[(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-[2-(1-adamantyl)ethanoylamino]ethanoate

Systemtic Name: [(2R)-1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-[2-(1-adamantyl)ethanoylamino]ethanoate Openeye Name: [(1R)-1-allophanoyl-2-methyl-propyl] 2-[[2-(1-adamantyl)acetyl]amino]acetate CAS Name: 2-[[2-(1-adamantyl)-1-oxoethyl]amino]acetic acid [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 2-[[2-(1-adamantyl)acetyl]amino]acetate Traditional Name: 2-[[2-(1-adamantyl)acetyl]amino]acetic acid [(1R)-1-allophanoyl-2-methyl-propyl] ester Formula: C20H31N3O5 MolecularWeight: 393.47724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)CNC(=O)CC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CC(C)[C@H](C(=O)NC(=O)N)OC(=O)CNC(=O)CC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C20H31N3O5/c1-11(2)17(18(26)23-19(21)27)28-16(25)10-22-15(24)9-20-6-12-3-13(7-20)5-14(4-12)8-20/h11-14,17H,3-10H2,1-2H3,(H,22,24)(H3,21,23,26,27)/t12?,13?,14?,17-,20?/m1/s1