tert-butyl 2-[[2-methylpropylcarbamoyl(propanoyloxy)amino]methyl]-3-phenyl-propanoate

Systemtic Name: tert-butyl 2-[[2-methylpropylcarbamoyl(propanoyloxy)amino]methyl]-3-phenyl-propanoate Openeye Name: tert-butyl 2-benzyl-3-[isobutylcarbamoyl(propanoyloxy)amino]propanoate CAS Name: 2-[[[(2-methylpropylamino)-oxomethyl]-(1-oxopropoxy)amino]methyl]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-benzyl-3-[2-methylpropylcarbamoyl(propanoyloxy)amino]propanoate Traditional Name: 2-benzyl-3-[isobutylcarbamoyl(propionyloxy)amino]propionic acid tert-butyl ester Formula: C22H34N2O5 MolecularWeight: 406.51576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)ON(CC(CC1=CC=CC=C1)C(=O)OC(C)(C)C)C(=O)NCC(C)C

Isomeric SMILES

CCC(=O)ON(CC(CC1=CC=CC=C1)C(=O)OC(C)(C)C)C(=O)NCC(C)C

InChI

InChI=1S/C22H34N2O5/c1-7-19(25)29-24(21(27)23-14-16(2)3)15-18(20(26)28-22(4,5)6)13-17-11-9-8-10-12-17/h8-12,16,18H,7,13-15H2,1-6H3,(H,23,27)