3-[2-azanylethyl-(3-oxidanyl-3-oxidanylidene-1-phenyl-propyl)amino]-3-phenyl-propanoic acid

Systemtic Name: 3-[2-azanylethyl-(3-oxidanyl-3-oxidanylidene-1-phenyl-propyl)amino]-3-phenyl-propanoic acid Openeye Name: 3-[2-aminoethyl-(3-hydroxy-3-oxo-1-phenyl-propyl)amino]-3-phenyl-propanoic acid CAS Name: 3-[2-aminoethyl-(3-hydroxy-3-oxo-1-phenylpropyl)amino]-3-phenylpropanoic acid IUPAC Name: 3-[2-aminoethyl-(3-hydroxy-3-oxo-1-phenylpropyl)amino]-3-phenylpropanoic acid Traditional Name: 3-[2-aminoethyl-(3-hydroxy-3-keto-1-phenyl-propyl)amino]-3-phenyl-propionic acid Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)N(CCN)C(CC(=O)O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)N(CCN)C(CC(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C20H24N2O4/c21-11-12-22(17(13-19(23)24)15-7-3-1-4-8-15)18(14-20(25)26)16-9-5-2-6-10-16/h1-10,17-18H,11-14,21H2,(H,23,24)(H,25,26)