2-[2-(2-methylpropyl)hexanoyl-(oxidanylcarbamoyl)amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2-(2-methylpropyl)hexanoyl-(oxidanylcarbamoyl)amino]-3-phenyl-propanoic acid Openeye Name: 2-[hydroxycarbamoyl(2-isobutylhexanoyl)amino]-3-phenyl-propanoic acid CAS Name: 2-[[(hydroxyamino)-oxomethyl]-[2-(2-methylpropyl)-1-oxohexyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[hydroxycarbamoyl-[2-(2-methylpropyl)hexanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[hydroxycarbamoyl(2-isobutylhexanoyl)amino]-3-phenyl-propionic acid Formula: C20H30N2O5 MolecularWeight: 378.4626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C)C)C(=O)N(C(CC1=CC=CC=C1)C(=O)O)C(=O)NO

Isomeric SMILES

CCCCC(CC(C)C)C(=O)N(C(CC1=CC=CC=C1)C(=O)O)C(=O)NO

InChI

InChI=1S/C20H30N2O5/c1-4-5-11-16(12-14(2)3)18(23)22(20(26)21-27)17(19(24)25)13-15-9-7-6-8-10-15/h6-10,14,16-17,27H,4-5,11-13H2,1-3H3,(H,21,26)(H,24,25)