2-[[2-(2-methylpropoxycarbonyl)-4-phenyl-butyl]-(2-methylpropylcarbamoyl)amino]propanoic acid

Systemtic Name: 2-[[2-(2-methylpropoxycarbonyl)-4-phenyl-butyl]-(2-methylpropylcarbamoyl)amino]propanoic acid Openeye Name: 2-[(2-isobutoxycarbonyl-4-phenyl-butyl)-(isobutylcarbamoyl)amino]propanoic acid CAS Name: 2-[[2-[2-methylpropoxy(oxo)methyl]-4-phenylbutyl]-[(2-methylpropylamino)-oxomethyl]amino]propanoic acid IUPAC Name: 2-[[2-(2-methylpropoxycarbonyl)-4-phenylbutyl]-(2-methylpropylcarbamoyl)amino]propanoic acid Traditional Name: 2-[(2-isobutoxycarbonyl-4-phenyl-butyl)-(isobutylcarbamoyl)amino]propionic acid Formula: C23H36N2O5 MolecularWeight: 420.54234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)N(CC(CCC1=CC=CC=C1)C(=O)OCC(C)C)C(C)C(=O)O

Isomeric SMILES

CC(C)CNC(=O)N(CC(CCC1=CC=CC=C1)C(=O)OCC(C)C)C(C)C(=O)O

InChI

InChI=1S/C23H36N2O5/c1-16(2)13-24-23(29)25(18(5)21(26)27)14-20(22(28)30-15-17(3)4)12-11-19-9-7-6-8-10-19/h6-10,16-18,20H,11-15H2,1-5H3,(H,24,29)(H,26,27)