2-azanyl-3-phenyl-propanoic acid; 4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid

Systemtic Name: 2-azanyl-3-phenyl-propanoic acid; 4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid Openeye Name: 2-amino-3-phenyl-propanoic acid; 2-(tert-butoxycarbonylamino)-4-methyl-pentanoic acid CAS Name: 2-amino-3-phenylpropanoic acid; 4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid IUPAC Name: 2-amino-3-phenylpropanoic acid; 4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid Traditional Name: 2-amino-3-phenyl-propionic acid; 2-(tert-butoxycarbonylamino)-4-methyl-valeric acid Formula: C20H32N2O6 MolecularWeight: 396.47788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H21NO4.C9H11NO2/c1-7(2)6-8(9(13)14)12-10(15)16-11(3,4)5;10-8(9(11)12)6-7-4-2-1-3-5-7/h7-8H,6H2,1-5H3,(H,12,15)(H,13,14);1-5,8H,6,10H2,(H,11,12)