2-azanyl-3-phenyl-propanoic acid; methyl 2-acetamido-4-methyl-pentanoate

Systemtic Name: 2-azanyl-3-phenyl-propanoic acid; methyl 2-acetamido-4-methyl-pentanoate Openeye Name: 2-amino-3-phenyl-propanoic acid; methyl 2-acetamido-4-methyl-pentanoate CAS Name: 2-acetamido-4-methylpentanoic acid methyl ester; 2-amino-3-phenylpropanoic acid IUPAC Name: 2-amino-3-phenylpropanoic acid; methyl 2-acetamido-4-methylpentanoate Traditional Name: 2-acetamido-4-methyl-valeric acid methyl ester; 2-amino-3-phenyl-propionic acid Formula: C18H28N2O5 MolecularWeight: 352.42532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H17NO3.C9H11NO2/c1-6(2)5-8(9(12)13-4)10-7(3)11;10-8(9(11)12)6-7-4-2-1-3-5-7/h6,8H,5H2,1-4H3,(H,10,11);1-5,8H,6,10H2,(H,11,12)