2-azanylpropane-1,3-diol; (2R)-2-[3-(phenylcarbonyl)phenyl]propanoic acid

Systemtic Name: 2-azanylpropane-1,3-diol; (2R)-2-[3-(phenylcarbonyl)phenyl]propanoic acid Openeye Name: 2-aminopropane-1,3-diol; (2R)-2-(3-benzoylphenyl)propanoic acid CAS Name: 2-aminopropane-1,3-diol; (2R)-2-(3-benzoylphenyl)propanoic acid IUPAC Name: 2-aminopropane-1,3-diol; (2R)-2-(3-benzoylphenyl)propanoic acid Traditional Name: 2-aminopropane-1,3-diol; (2R)-2-(3-benzoylphenyl)propionic acid Formula: C19H23NO5 MolecularWeight: 345.38962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)O.C(C(CO)N)O

Isomeric SMILES

C[C@H](C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)O.C(C(CO)N)O

InChI

InChI=1S/C16H14O3.C3H9NO2/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12;4-3(1-5)2-6/h2-11H,1H3,(H,18,19);3,5-6H,1-2,4H2/t11-;/m1./s1